CID 39163800
PubChem CID
39163800
Structure
Molecular Formula
Status
Non-live
Molecular Weight
265.3 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
1-[(2S)-2-methyl-2,3-dihydro-1H-indol-5-yl]-3-phenylpropan-1-one
InChI=1S/C18H19NO/c1-13-11-16-12-15(8-9-17(16)19-13)18(20)10-7-14-5-3-2-4-6-14/h2-6,8-9,12-13,19H,7,10-11H2,1H3/t13-/m0/s1
IMTYDQVWGXSRCP-ZDUSSCGKSA-N
C[C@H]1CC2=C(N1)C=CC(=C2)C(=O)CCC3=CC=CC=C3
C18H19NO
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
265.3 g/mol
Property Name
XLogP3-AA
Property Value
3.9
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
4
Property Name
Exact Mass
Property Value
265.146664230 g/mol
Property Name
Monoisotopic Mass
Property Value
265.146664230 g/mol
Property Name
Topological Polar Surface Area
Property Value
29.1 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
334
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
CONTENTS