2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide

C21H30N2O2 — CID 4108713

IUPAC2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
SMILESCC1CCC(NC(=O)C2(C)CCC(=O)N2CCc2ccccc2)CC1
InChIInChI=1S/C21H30N2O2/c1-16-8-10-18(11-9-16)22-20(25)21(2)14-12-19(24)23(21)15-13-17-6-4-3-5-7-17/h3-7,16,18H,8-15H2,1-2H3,(H,22,25)
InChIKeyODBPLTBESUGNOZ-UHFFFAOYSA-N
MW342.48 g/mol
LogP3.31
Rot. Bonds5

About 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide

2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide (PubChem CID 4108713) has the molecular formula C21H30N2O2 and a molecular weight of 342.48 g/mol. Its IUPAC name is 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
PubChem CID4108713
Molecular FormulaC21H30N2O2
Molecular Weight342.48 g/mol
Exact Mass342.23
IUPAC Name2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
SMILESCC1CCC(NC(=O)C2(C)CCC(=O)N2CCc2ccccc2)CC1
InChIInChI=1S/C21H30N2O2/c1-16-8-10-18(11-9-16)22-20(25)21(2)14-12-19(24)23(21)15-13-17-6-4-3-5-7-17/h3-7,16,18H,8-15H2,1-2H3,(H,22,25)
InChIKeyODBPLTBESUGNOZ-UHFFFAOYSA-N
XLogP3.31
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.48
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide 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

2-methyl-N-(4-methylcyclohexyl)-1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 3701224
(2R)-N-(2-methoxyethyl)-2-methyl-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
CID 92731008
(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
CID 92734308
(2R)-N-benzyl-2-methyl-1-[2-(4-methylsulfanylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 92719936
4-ethyl-11-methyl-N-(4-methylcyclohexyl)-9-oxo-10-(2-phenylethyl)-5-thia-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7-triene-11-carboxamide
CID 22514807
N-benzyl-2-methyl-5-oxo-1-(3-phenylpropyl)pyrrolidine-2-carboxamide
CID 46247148
(2S)-N-cyclopentyl-1-[(3-fluorophenyl)methyl]-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 92719907
N-cyclopentyl-1-ethyl-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 45106070
(2R)-N-benzyl-2-methyl-1-[2-(2-methylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 92734431
N-cyclooctyl-3-methyl-1-oxo-2-(2-phenylethyl)-4H-isoquinoline-3-carboxamide
CID 20885762
(3S)-6-(furan-2-yl)-3-methyl-N-(4-methylcyclohexyl)-1-oxo-2-(3-phenylpropyl)-4H-pyrrolo[1,2-a]pyrazine-3-carboxamide
CID 92741130
(3R)-3-methyl-N-(4-methylcyclohexyl)-1-oxo-2-(3-phenylpropyl)-4H-pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 92740488

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide (CID 4108713) is 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide is CC1CCC(NC(=O)C2(C)CCC(=O)N2CCc2ccccc2)CC1.
What is the InChIKey of 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
The InChIKey is ODBPLTBESUGNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O2/c1-16-8-10-18(11-9-16)22-20(25)21(2)14-12-19(24)23(21)15-13-17-6-4-3-5-7-17/h3-7,16,18H,8-15H2,1-2H3,(H,22,25).
What are the key properties of 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide has a molecular weight of 342.48 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 4108713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).