4626 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 8 8 8 7 7 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 2 3 4 4 4 5 5 5 6 6 6 7 7 8 8 8 10 10 10 6 19 9 11 7 9 10 11 20 21 7 8 12 13 14 9 15 16 11 17 18 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6 1 7 8 12 3 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 4.8479 2 5.4921 3.7601 4.6261 4.2601 4.5691 3.2601 2.9511 3.7601 4.6261 4.8724 5.1355 4.8791 2.6536 3.3249 3.548 3.1495 4.5957 5.163 4.0892 -2.2957 -0.2266 1.0521 0.0521 2.5521 -1.4867 -0.5357 -1.4867 -0.5357 1.0521 1.5521 -1.3897 -0.7878 0.0013 -1.6156 -2.1033 1.6347 0.9445 -2.8621 2.8621 2.8621 3 6 1 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.384 Cactvs xemistry.com 2011.09.13 192 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.384 Cactvs xemistry.com 2011.09.13 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.384 Cactvs xemistry.com 2011.09.13 2 Count Rotatable Bond 5 E_NROTBONDS 3.384 Cactvs xemistry.com 2011.09.13 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.384 Cactvs xemistry.com 2011.09.13 00000371C0633000000000000000000000000000000160000000000000000000000000000000001E00100800000814E180060000034002000800011010000000000000000000018800000250140080201440000236009000000400000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.0.2 LexiChem openeye.com 2011.09.13 2-(4-hydroxy-2-oxo-pyrrolidin-1-yl)acetamide IUPAC Name CAS-like Style 1 2.0.2 LexiChem openeye.com 2011.09.13 2-(4-hydroxy-2-oxo-1-pyrrolidinyl)acetamide IUPAC Name Preferred 1 2.0.2 LexiChem openeye.com 2011.09.13 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide IUPAC Name Systematic 1 2.0.2 LexiChem openeye.com 2011.09.13 2-(4-oxidanyl-2-oxidanylidene-pyrrolidin-1-yl)ethanamide IUPAC Name Traditional 1 2.0.2 LexiChem openeye.com 2011.09.13 2-(4-hydroxy-2-keto-pyrrolidino)acetamide InChI Standard 1 1.0.3 InChI nist.gov 2011.09.13 InChI=1S/C6H10N2O3/c7-5(10)3-8-2-4(9)1-6(8)11/h4,9H,1-3H2,(H2,7,10) InChIKey Standard 1 1.0.3 InChI nist.gov 2011.09.13 IHLAQQPQKRMGSS-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2011.09.13 -2.2 Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 158.069142 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 C6H10N2O3 Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 158.1552 SMILES Canonical 1 1.7.4 OEChem openeye.com 2011.09.13 C1C(CN(C1=O)CC(=O)N)O SMILES Isomeric 1 1.7.4 OEChem openeye.com 2011.09.13 C1C(CN(C1=O)CC(=O)N)O Topological Polar Surface Area 7 E_TPSA 3.384 Cactvs xemistry.com 2011.09.13 83.6 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 158.069142 11 1 0 1 0 0 0 0 1 6