4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide

C22H26N2O2 — CID 24601128

IUPAC4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESCCCCc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1
InChIInChI=1S/C22H26N2O2/c1-3-4-6-17-8-10-18(11-9-17)22(26)23-19-12-13-20(16(2)15-19)24-14-5-7-21(24)25/h8-13,15H,3-7,14H2,1-2H3,(H,23,26)
InChIKeyIFMAZDKCXNLCIP-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.72
Rot. Bonds6

About 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide

4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide (PubChem CID 24601128) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
PubChem CID24601128
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESCCCCc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1
InChIInChI=1S/C22H26N2O2/c1-3-4-6-17-8-10-18(11-9-17)22(26)23-19-12-13-20(16(2)15-19)24-14-5-7-21(24)25/h8-13,15H,3-7,14H2,1-2H3,(H,23,26)
InChIKeyIFMAZDKCXNLCIP-UHFFFAOYSA-N
XLogP4.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide 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

4-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoic acid
CID 45393767
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18204867
4-butyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 8589902
3-(4-ethylphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 24601082
4-butoxy-N-[4-methyl-3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687807
3-methyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-morpholin-4-ylbenzamide
CID 131952772
N'-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-N-propyloxamide
CID 30679260
2,3-dimethyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 42140218
2,5-dimethyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 42140184
3-(ethylsulfamoyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 24613493
1-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-3-[3-(4-propan-2-ylphenyl)propyl]thiourea
CID 100756857
1-ethyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-2,3-dioxo-4H-quinoxaline-6-carboxamide
CID 24613478

Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The IUPAC name of 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide (CID 24601128) is 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The canonical SMILES for 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide is CCCCc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(C)c2)cc1.
What is the InChIKey of 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The InChIKey is IFMAZDKCXNLCIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-3-4-6-17-8-10-18(11-9-17)22(26)23-19-12-13-20(16(2)15-19)24-14-5-7-21(24)25/h8-13,15H,3-7,14H2,1-2H3,(H,23,26).
What are the key properties of 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide has a molecular weight of 350.46 g/mol, XLogP of 4.72, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 24601128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).