3-amino-1,5-diphenylpyrrolidin-2-one

C16H16N2O — CID 131864676

IUPAC3-amino-1,5-diphenylpyrrolidin-2-one
SMILESNC1CC(c2ccccc2)N(c2ccccc2)C1=O
InChIInChI=1S/C16H16N2O/c17-14-11-15(12-7-3-1-4-8-12)18(16(14)19)13-9-5-2-6-10-13/h1-10,14-15H,11,17H2
InChIKeyXNMGUMJYAWHQKJ-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.49
Rot. Bonds2

About 3-amino-1,5-diphenylpyrrolidin-2-one

3-amino-1,5-diphenylpyrrolidin-2-one (PubChem CID 131864676) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 3-amino-1,5-diphenylpyrrolidin-2-one.

Molecular Properties

Compound Name3-amino-1,5-diphenylpyrrolidin-2-one
PubChem CID131864676
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name3-amino-1,5-diphenylpyrrolidin-2-one
SMILESNC1CC(c2ccccc2)N(c2ccccc2)C1=O
InChIInChI=1S/C16H16N2O/c17-14-11-15(12-7-3-1-4-8-12)18(16(14)19)13-9-5-2-6-10-13/h1-10,14-15H,11,17H2
InChIKeyXNMGUMJYAWHQKJ-UHFFFAOYSA-N
XLogP2.49
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-1-methyl-5-phenyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 22599547
(3S,5S)-3-amino-1-methyl-5-phenyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 129383805
carbonyl difluoride;(3R,5R)-3-[2-methyl-2-[6-(trifluoromethyl)-2-pyridinyl]propyl]-1,5-diphenylpyrrolidin-2-one
CID 160985414
(3R,5R)-1,5-diphenylpyrrolidin-3-amine
CID 125491761
3-amino-4,5-dimethyl-1-phenylpyrrolidin-2-one
CID 70547159
(3R,5R)-1-benzyl-3-methyl-5-phenylpyrrolidin-2-one
CID 102276897
3-amino-1-methyl-5-pyridin-4-ylpyrrolidin-2-one
CID 121209528
(3R,4S)-3-hydroxy-1,4-diphenylazetidin-2-one
CID 11424956
2-(3-amino-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide
CID 57036053
4-amino-9-methyl-13-oxa-2-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7(12),8,10,14,16-hexaen-3-one
CID 21420491
3-amino-5-(3-fluorophenyl)-1-methylpyrrolidin-2-one
CID 121209523
(4S)-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 10354907

Frequently Asked Questions

What is the IUPAC name of 3-amino-1,5-diphenylpyrrolidin-2-one?
The IUPAC name of 3-amino-1,5-diphenylpyrrolidin-2-one (CID 131864676) is 3-amino-1,5-diphenylpyrrolidin-2-one.
What is the SMILES notation for 3-amino-1,5-diphenylpyrrolidin-2-one?
The canonical SMILES for 3-amino-1,5-diphenylpyrrolidin-2-one is NC1CC(c2ccccc2)N(c2ccccc2)C1=O.
What is the InChIKey of 3-amino-1,5-diphenylpyrrolidin-2-one?
The InChIKey is XNMGUMJYAWHQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c17-14-11-15(12-7-3-1-4-8-12)18(16(14)19)13-9-5-2-6-10-13/h1-10,14-15H,11,17H2.
What are the key properties of 3-amino-1,5-diphenylpyrrolidin-2-one?
3-amino-1,5-diphenylpyrrolidin-2-one has a molecular weight of 252.32 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1,5-diphenylpyrrolidin-2-one is sourced from PubChem (CID 131864676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).