(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide

C16H28N2O3 — CID 97025142

IUPAC(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide
SMILESCC[C@H](C(=O)NC[C@@H](O)C1CCCCC1)N1CCCC1=O
InChIInChI=1S/C16H28N2O3/c1-2-13(18-10-6-9-15(18)20)16(21)17-11-14(19)12-7-4-3-5-8-12/h12-14,19H,2-11H2,1H3,(H,17,21)/t13-,14-/m1/s1
InChIKeyXPMZZSCLVSIAIA-ZIAGYGMSSA-N
MW296.41 g/mol
LogP1.44
Rot. Bonds6

About (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide

(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide (PubChem CID 97025142) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide.

Molecular Properties

Compound Name(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide
PubChem CID97025142
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC Name(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide
SMILESCC[C@H](C(=O)NC[C@@H](O)C1CCCCC1)N1CCCC1=O
InChIInChI=1S/C16H28N2O3/c1-2-13(18-10-6-9-15(18)20)16(21)17-11-14(19)12-7-4-3-5-8-12/h12-14,19H,2-11H2,1H3,(H,17,21)/t13-,14-/m1/s1
InChIKeyXPMZZSCLVSIAIA-ZIAGYGMSSA-N
XLogP1.44
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-N-hydroxy-2-(2-oxopyrrolidin-1-yl)butanamide
CID 135817952
2-(2-oxopyrrolidin-1-yl)-N-(2-pyrrolidin-3-ylethyl)butanamide
CID 119535176
methyl (2R)-2-(2-oxopyrrolidin-1-yl)butanoate
CID 68788045
(2R)-N-[(1R,3S)-3-methoxy-2,2,3-trimethylcyclobutyl]-2-(2-oxopyrrolidin-1-yl)butanamide
CID 129428982
(2R)-N-[2-(1-methylimidazol-2-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)butanamide
CID 97218671
N-(2-cyclopentyl-2-hydroxyethyl)-5-methyl-2-(2-oxopyrrolidin-1-yl)benzamide
CID 111912006
N-cyclopentyl-1-[2-(2-oxopyrrolidin-1-yl)butanoyl]piperidine-3-sulfonamide
CID 127802994
N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide
CID 95292122
N-(1-cyanopropan-2-yl)-2-(2-oxopyrrolidin-1-yl)butanamide
CID 75374671
N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylbutanamide
CID 63294520
(2R)-N-[(2S,3S)-2-(4-fluorophenyl)-1-methylpyrrolidin-3-yl]-2-(2-oxopyrrolidin-1-yl)butanamide
CID 124840387
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide
CID 100700120

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide?
The IUPAC name of (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide (CID 97025142) is (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide.
What is the SMILES notation for (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide?
The canonical SMILES for (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide is CC[C@H](C(=O)NC[C@@H](O)C1CCCCC1)N1CCCC1=O.
What is the InChIKey of (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide?
The InChIKey is XPMZZSCLVSIAIA-ZIAGYGMSSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-2-13(18-10-6-9-15(18)20)16(21)17-11-14(19)12-7-4-3-5-8-12/h12-14,19H,2-11H2,1H3,(H,17,21)/t13-,14-/m1/s1.
What are the key properties of (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide?
(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide has a molecular weight of 296.41 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide is sourced from PubChem (CID 97025142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).