2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide

C15H22N2O2 — CID 113158704

IUPAC2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide
SMILESCCCCN(CC(=O)Nc1ccc(C)cc1)C(C)=O
InChIInChI=1S/C15H22N2O2/c1-4-5-10-17(13(3)18)11-15(19)16-14-8-6-12(2)7-9-14/h6-9H,4-5,10-11H2,1-3H3,(H,16,19)
InChIKeyVPUZPFQMRNUBBH-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.58
Rot. Bonds6

About 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide

2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide (PubChem CID 113158704) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide
PubChem CID113158704
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide
SMILESCCCCN(CC(=O)Nc1ccc(C)cc1)C(C)=O
InChIInChI=1S/C15H22N2O2/c1-4-5-10-17(13(3)18)11-15(19)16-14-8-6-12(2)7-9-14/h6-9H,4-5,10-11H2,1-3H3,(H,16,19)
InChIKeyVPUZPFQMRNUBBH-UHFFFAOYSA-N
XLogP2.58
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide 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-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide
CID 113158729
2-[acetyl(3-methylbutyl)amino]-N-(4-methylphenyl)acetamide
CID 113166544
2-[acetyl(pentyl)amino]-N-(2,5-dimethylphenyl)acetamide
CID 113166745
2-[acetyl(pentyl)amino]-N-(3,4-difluorophenyl)acetamide
CID 113166842
N-butyl-N-[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 3597840
N-butyl-2-methyl-N-[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 5183706
2-[acetyl-[3-(dimethylamino)propyl]amino]-N-(4-ethylphenyl)acetamide
CID 113160867
2-[acetyl(butyl)amino]-N-[4-[(4-chlorophenyl)methoxy]phenyl]acetamide
CID 113158789
2-[acetyl(butyl)amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 113158787
N-(4-methylphenyl)pentanamide
CID 3662375
2-(4-methyl-N-[2-(4-methylanilino)-2-oxoethyl]anilino)-N-(4-methylphenyl)acetamide
CID 2645683
(2R)-N-butyl-2-ethyl-N-[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]hexanamide
CID 7330763

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide (CID 113158704) is 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide is CCCCN(CC(=O)Nc1ccc(C)cc1)C(C)=O.
What is the InChIKey of 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide?
The InChIKey is VPUZPFQMRNUBBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-5-10-17(13(3)18)11-15(19)16-14-8-6-12(2)7-9-14/h6-9H,4-5,10-11H2,1-3H3,(H,16,19).
What are the key properties of 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide?
2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 113158704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).