1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide

C22H25N3O3 — CID 55642807

IUPAC1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide
SMILESCNC(=O)Cc1ccccc1NC(=O)C1CC(=O)N(c2cccc(C)c2C)C1
InChIInChI=1S/C22H25N3O3/c1-14-7-6-10-19(15(14)2)25-13-17(12-21(25)27)22(28)24-18-9-5-4-8-16(18)11-20(26)23-3/h4-10,17H,11-13H2,1-3H3,(H,23,26)(H,24,28)
InChIKeyFWQZWXKJYGSDNM-UHFFFAOYSA-N
MW379.46 g/mol
LogP2.58
Rot. Bonds5

About 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide

1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 55642807) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID55642807
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide
SMILESCNC(=O)Cc1ccccc1NC(=O)C1CC(=O)N(c2cccc(C)c2C)C1
InChIInChI=1S/C22H25N3O3/c1-14-7-6-10-19(15(14)2)25-13-17(12-21(25)27)22(28)24-18-9-5-4-8-16(18)11-20(26)23-3/h4-10,17H,11-13H2,1-3H3,(H,23,26)(H,24,28)
InChIKeyFWQZWXKJYGSDNM-UHFFFAOYSA-N
XLogP2.58
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-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-[2-[[1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]phenyl]acetic acid
CID 119218549
1-(2,3-dimethylphenyl)-5-oxo-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide
CID 55676988
1-(2,3-dimethylphenyl)-N-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 42997101
(3S)-N-(3-chloro-2-methylphenyl)-1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 41133153
(3R)-1-(3-chloro-2-methylphenyl)-N-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9056272
(3S)-1-(3-chloro-2-methylphenyl)-N-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 1233393
1-(3-chloro-2-methylphenyl)-N-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2932312
(3S)-N-(2-methylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 26914330
1-(2,3-dimethylphenyl)-N-[4-(methylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 51147058
(3R)-N-(2,3-dimethylphenyl)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2599596
(3S)-N-(2,4-dibromophenyl)-1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 124529075
(3R)-N-(5-chloro-2-fluorophenyl)-1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 51532988

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide (CID 55642807) is 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide is CNC(=O)Cc1ccccc1NC(=O)C1CC(=O)N(c2cccc(C)c2C)C1.
What is the InChIKey of 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is FWQZWXKJYGSDNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-14-7-6-10-19(15(14)2)25-13-17(12-21(25)27)22(28)24-18-9-5-4-8-16(18)11-20(26)23-3/h4-10,17H,11-13H2,1-3H3,(H,23,26)(H,24,28).
What are the key properties of 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide?
1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 55642807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).