2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide

C13H16N2O2 — CID 12884396

IUPAC2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide
SMILESO=C1CCCN1C(=O)NCCc1ccccc1
InChIInChI=1S/C13H16N2O2/c16-12-7-4-10-15(12)13(17)14-9-8-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,14,17)
InChIKeyAKOOCRLKEXBUBA-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.56
Rot. Bonds3

About 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide

2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide (PubChem CID 12884396) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide
PubChem CID12884396
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide
SMILESO=C1CCCN1C(=O)NCCc1ccccc1
InChIInChI=1S/C13H16N2O2/c16-12-7-4-10-15(12)13(17)14-9-8-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,14,17)
InChIKeyAKOOCRLKEXBUBA-UHFFFAOYSA-N
XLogP1.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-phenylpropyl)-3,4-dihydro-2H-quinoline-1-carboxamide
CID 108990483
1-(2-phenylacetyl)pyrrolidin-2-one
CID 13011419
3-methyl-2-(2-oxopyrrolidin-1-yl)-N-(2-phenylethyl)butanamide
CID 51100996
N-(4-anilino-4-oxobutyl)-2-oxoazepane-1-carboxamide
CID 134938916
2-phenylethylcarbamothioic S-acid
CID 11116669
(2S)-1-(2-phenylethylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 28509967
4-chloro-N-(2-phenylethyl)butanamide;methane;1-(2-phenylethyl)pyrrolidin-2-one
CID 158371440
N-(3-phenylpropyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69224185
5-benzamido-N-(2-phenylethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 102082728
N-(2-phenylethyl)diazinane-1-carboxamide
CID 69213478
1-(2,2-dideuterio-5-phenylpentanoyl)azepan-2-one
CID 102595226
1-[[2-(2-oxoazepan-1-yl)acetyl]amino]-3-(2-phenylethyl)thiourea
CID 8677167

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide?
The IUPAC name of 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide (CID 12884396) is 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide is O=C1CCCN1C(=O)NCCc1ccccc1.
What is the InChIKey of 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide?
The InChIKey is AKOOCRLKEXBUBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c16-12-7-4-10-15(12)13(17)14-9-8-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,14,17).
What are the key properties of 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide?
2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide has a molecular weight of 232.28 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(2-phenylethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 12884396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).