2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide

C19H20N2O2 — CID 46902878

IUPAC2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide
SMILESC[C@H]1CN(c2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-14-13-21(16-10-6-3-7-11-16)19(23)17(14)12-18(22)20-15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3,(H,20,22)/t14-,17+/m0/s1
InChIKeyWVQPZFCJBKRKBA-WMLDXEAASA-N
MW308.38 g/mol
LogP3.31
Rot. Bonds4

About 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide

2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide (PubChem CID 46902878) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide
PubChem CID46902878
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide
SMILESC[C@H]1CN(c2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1
InChIInChI=1S/C19H20N2O2/c1-14-13-21(16-10-6-3-7-11-16)19(23)17(14)12-18(22)20-15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3,(H,20,22)/t14-,17+/m0/s1
InChIKeyWVQPZFCJBKRKBA-WMLDXEAASA-N
XLogP3.31
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ML252
CID 26873419
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1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
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N-(3-benzylphenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
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N-([1,1'-Biphenyl]-3-yl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
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(2S)-1-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanoyl]-N-phenylpyrrolidine-2-carboxamide
CID 23646334
N-[4-(diethylamino)phenyl]cyclopentanecarboxamide
CID 849594
2-phenyl-N-[4-(1-pyrrolidinylcarbonyl)phenyl]butanamide
CID 2971289
N-cyclopropyl-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 3127068
N-(2-phenylethyl)-N'-[4-(propan-2-yl)phenyl]pentanediamide
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CID 3354062

Frequently Asked Questions

What is the IUPAC name of 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide?
The IUPAC name of 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide (CID 46902878) is 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide?
The canonical SMILES for 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide is C[C@H]1CN(c2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1.
What is the InChIKey of 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide?
The InChIKey is WVQPZFCJBKRKBA-WMLDXEAASA-N. The full InChI is InChI=1S/C19H20N2O2/c1-14-13-21(16-10-6-3-7-11-16)19(23)17(14)12-18(22)20-15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3,(H,20,22)/t14-,17+/m0/s1.
What are the key properties of 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide?
2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide has a molecular weight of 308.38 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R,4R)-4-methyl-2-oxo-1-phenylpyrrolidin-3-yl]-N-phenylacetamide is sourced from PubChem (CID 46902878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).