248144 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 8 8 7 7 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 3 3 4 4 5 5 5 5 7 7 7 8 8 8 9 9 9 10 11 11 11 6 10 4 6 19 9 10 6 7 8 12 13 14 15 16 17 18 20 21 22 11 23 24 25 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 3.732 6.3301 4.5981 5.4641 2.866 3.732 2 2.866 5.4641 6.3301 7.1962 2.866 2.31 1.4631 1.69 2.246 2.866 3.486 4.5981 6.0841 5.4641 4.8441 7.5062 7.7331 6.8862 1.25 -1.25 -0.25 0.25 -0.25 0.25 0.25 -1.25 1.25 -0.25 0.25 0.37 0.7869 0.56 -0.2869 -1.25 -1.87 -1.25 -0.87 1.25 1.87 1.25 -0.2869 0.56 0.7869 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.384 Cactvs xemistry.com 2011.09.13 166 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.384 Cactvs xemistry.com 2011.09.13 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.384 Cactvs xemistry.com 2011.09.13 1 Count Rotatable Bond 5 E_NROTBONDS 3.384 Cactvs xemistry.com 2011.09.13 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.384 Cactvs xemistry.com 2011.09.13 00000371C0633000000000000000000000000000000000000000000000000000000000000000001E00180000000D008180040200026200000800011010000000000000001220010800000000000000000000000012000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.0.2 LexiChem openeye.com 2011.09.13 N'-acetyl-N',2-dimethyl-propanehydrazide IUPAC Name CAS-like Style 1 2.0.2 LexiChem openeye.com 2011.09.13 N'-acetyl-N',2-dimethylpropanehydrazide IUPAC Name Preferred 1 2.0.2 LexiChem openeye.com 2011.09.13 N'-acetyl-N',2-dimethylpropanehydrazide IUPAC Name Systematic 1 2.0.2 LexiChem openeye.com 2011.09.13 N'-ethanoyl-N',2-dimethyl-propanehydrazide IUPAC Name Traditional 1 2.0.2 LexiChem openeye.com 2011.09.13 N'-acetyl-N',2-dimethyl-propionohydrazide InChI Standard 1 1.0.3 InChI nist.gov 2011.09.13 InChI=1S/C7H14N2O2/c1-5(2)7(11)8-9(4)6(3)10/h5H,1-4H3,(H,8,11) InChIKey Standard 1 1.0.3 InChI nist.gov 2011.09.13 SIWADVDDFLLWPE-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2011.09.13 0.3 Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 158.105528 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 C7H14N2O2 Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 158.19826 SMILES Canonical 1 1.7.4 OEChem openeye.com 2011.09.13 CC(C)C(=O)NN(C)C(=O)C SMILES Isomeric 1 1.7.4 OEChem openeye.com 2011.09.13 CC(C)C(=O)NN(C)C(=O)C Topological Polar Surface Area 7 E_TPSA 3.384 Cactvs xemistry.com 2011.09.13 49.4 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 158.105528 11 0 0 0 0 0 0 0 1 2