(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide

C19H28N2O2 — CID 92734308

IUPAC(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
SMILESCC(C)CCNC(=O)[C@@]1(C)CCC(=O)N1CCc1ccccc1
InChIInChI=1S/C19H28N2O2/c1-15(2)10-13-20-18(23)19(3)12-9-17(22)21(19)14-11-16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H,20,23)/t19-/m1/s1
InChIKeySMXXCOAVSWPCHQ-LJQANCHMSA-N
MW316.44 g/mol
LogP2.77
Rot. Bonds7

About (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide

(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide (PubChem CID 92734308) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
PubChem CID92734308
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
SMILESCC(C)CCNC(=O)[C@@]1(C)CCC(=O)N1CCc1ccccc1
InChIInChI=1S/C19H28N2O2/c1-15(2)10-13-20-18(23)19(3)12-9-17(22)21(19)14-11-16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H,20,23)/t19-/m1/s1
InChIKeySMXXCOAVSWPCHQ-LJQANCHMSA-N
XLogP2.77
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-2-methyl-N-(3-methylbutyl)-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

(2S)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(3-phenylpropyl)pyrrolidine-2-carboxamide
CID 92734293
2-methyl-N,1-bis(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide
CID 46247100
(2R)-N-(2-methoxyethyl)-2-methyl-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
CID 92731008
2-[2-(4-chlorophenyl)ethyl]-3-methyl-N-(3-methylbutyl)-1-oxo-4,5-dihydro-2-benzazepine-3-carboxamide
CID 46259450
(2R)-N-benzyl-2-methyl-1-[2-(4-methylsulfanylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 92719936
N-benzyl-2-methyl-5-oxo-1-(3-phenylpropyl)pyrrolidine-2-carboxamide
CID 46247148
(2S)-1-[2-(2,4-dimethoxyphenyl)ethyl]-2-methyl-N-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide
CID 92734332
4-methyl-N-(3-methylbutyl)-2-oxo-3-(2-phenylethyl)-3-azabicyclo[5.4.1]dodeca-8,10-diene-4-carboxamide
CID 143555889
1-[2-(4-ethylpiperazin-1-yl)ethyl]-2-methyl-N-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide
CID 46247133
(2R)-N-(2-methoxyethyl)-2-methyl-1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 92731010
(2R)-N-benzyl-2-methyl-1-[2-(2-methylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 92734431
2-methyl-N-(4-methylcyclohexyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide
CID 4108713

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide (CID 92734308) is (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide is CC(C)CCNC(=O)[C@@]1(C)CCC(=O)N1CCc1ccccc1.
What is the InChIKey of (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
The InChIKey is SMXXCOAVSWPCHQ-LJQANCHMSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-15(2)10-13-20-18(23)19(3)12-9-17(22)21(19)14-11-16-7-5-4-6-8-16/h4-8,15H,9-14H2,1-3H3,(H,20,23)/t19-/m1/s1.
What are the key properties of (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide?
(2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide has a molecular weight of 316.44 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-N-(3-methylbutyl)-5-oxo-1-(2-phenylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 92734308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).