4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide

C23H28N4O3 — CID 46983390

IUPAC4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCCCCC(=O)Nc1ccc(NC(=O)c2ccc(C)c(N3CCNC3=O)c2)cc1C
InChIInChI=1S/C23H28N4O3/c1-4-5-6-21(28)26-19-10-9-18(13-16(19)3)25-22(29)17-8-7-15(2)20(14-17)27-12-11-24-23(27)30/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,24,30)(H,25,29)(H,26,28)
InChIKeyXUZFFRUTJWKJPQ-UHFFFAOYSA-N
MW408.50 g/mol
LogP4.21
Rot. Bonds7

About 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide

4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 46983390) has the molecular formula C23H28N4O3 and a molecular weight of 408.50 g/mol. Its IUPAC name is 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound Name4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID46983390
Molecular FormulaC23H28N4O3
Molecular Weight408.50 g/mol
Exact Mass408.22
IUPAC Name4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide
SMILESCCCCC(=O)Nc1ccc(NC(=O)c2ccc(C)c(N3CCNC3=O)c2)cc1C
InChIInChI=1S/C23H28N4O3/c1-4-5-6-21(28)26-19-10-9-18(13-16(19)3)25-22(29)17-8-7-15(2)20(14-17)27-12-11-24-23(27)30/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,24,30)(H,25,29)(H,26,28)
InChIKeyXUZFFRUTJWKJPQ-UHFFFAOYSA-N
XLogP4.21
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.50
LogP ≤ 54.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)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

3-methyl-N-[4-(methylcarbamoyl)phenyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 60566894
N-[4-(4-aminobutanoylamino)-2-methylphenyl]pentanamide
CID 39193527
N-(4-formamido-2-methylphenyl)pentanamide
CID 168653385
4-methyl-N-[(3-methylthiophen-2-yl)methyl]-3-(2-oxoimidazolidin-1-yl)benzamide
CID 50955536
N-[3-[4-methyl-3-(2-oxoimidazolidin-1-yl)anilino]-3-oxopropyl]pyrrolidine-2-carboxamide
CID 166398472
4-(2-oxoimidazolidin-1-yl)-N-(4-pentylphenyl)benzamide
CID 134055766
3-methyl-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 49422566
N-(2,4-dimethylphenyl)-4-(hexanoylamino)benzamide
CID 3645447
4-(henicosanoylamino)-3-methylbenzoic acid
CID 12800016
N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 46682517
N-[3-methoxy-4-(pentanoylamino)phenyl]-4-methyl-3-nitrobenzamide
CID 3776414
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-4-methoxy-3-(2-oxoimidazolidin-1-yl)benzamide
CID 71873314

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide (CID 46983390) is 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide is CCCCC(=O)Nc1ccc(NC(=O)c2ccc(C)c(N3CCNC3=O)c2)cc1C.
What is the InChIKey of 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is XUZFFRUTJWKJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O3/c1-4-5-6-21(28)26-19-10-9-18(13-16(19)3)25-22(29)17-8-7-15(2)20(14-17)27-12-11-24-23(27)30/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,24,30)(H,25,29)(H,26,28).
What are the key properties of 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide?
4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 408.50 g/mol, XLogP of 4.21, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[3-methyl-4-(pentanoylamino)phenyl]-3-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 46983390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).