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

C21H24N2O2 — CID 46902880

IUPAC2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide
SMILESC[C@H]1CN(CCc2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1
InChIInChI=1S/C21H24N2O2/c1-16-15-23(13-12-17-8-4-2-5-9-17)21(25)19(16)14-20(24)22-18-10-6-3-7-11-18/h2-11,16,19H,12-15H2,1H3,(H,22,24)/t16-,19+/m0/s1
InChIKeyDOLQEDTWHRFYBS-QFBILLFUSA-N
MW336.44 g/mol
LogP3.35
Rot. Bonds6

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

2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide (PubChem CID 46902880) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide
PubChem CID46902880
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide
SMILESC[C@H]1CN(CCc2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1
InChIInChI=1S/C21H24N2O2/c1-16-15-23(13-12-17-8-4-2-5-9-17)21(25)19(16)14-20(24)22-18-10-6-3-7-11-18/h2-11,16,19H,12-15H2,1H3,(H,22,24)/t16-,19+/m0/s1
InChIKeyDOLQEDTWHRFYBS-QFBILLFUSA-N
XLogP3.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide?
The IUPAC name of 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide (CID 46902880) is 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide?
The canonical SMILES for 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide is C[C@H]1CN(CCc2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1.
What is the InChIKey of 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide?
The InChIKey is DOLQEDTWHRFYBS-QFBILLFUSA-N. The full InChI is InChI=1S/C21H24N2O2/c1-16-15-23(13-12-17-8-4-2-5-9-17)21(25)19(16)14-20(24)22-18-10-6-3-7-11-18/h2-11,16,19H,12-15H2,1H3,(H,22,24)/t16-,19+/m0/s1.
What are the key properties of 2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide?
2-[(3R,4R)-4-methyl-2-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide has a molecular weight of 336.44 g/mol, XLogP of 3.35, 6 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-(2-phenylethyl)pyrrolidin-3-yl]-N-phenylacetamide is sourced from PubChem (CID 46902880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).