N-(2,4-dimethylphenyl)-3-methylpentanamide

C14H21NO — CID 54564506

IUPACN-(2,4-dimethylphenyl)-3-methylpentanamide
SMILESCCC(C)CC(=O)Nc1ccc(C)cc1C
InChIInChI=1S/C14H21NO/c1-5-10(2)9-14(16)15-13-7-6-11(3)8-12(13)4/h6-8,10H,5,9H2,1-4H3,(H,15,16)
InChIKeyZSWMMZMXRSEWBN-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.68
Rot. Bonds4

About N-(2,4-dimethylphenyl)-3-methylpentanamide

N-(2,4-dimethylphenyl)-3-methylpentanamide (PubChem CID 54564506) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-3-methylpentanamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-3-methylpentanamide
PubChem CID54564506
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-(2,4-dimethylphenyl)-3-methylpentanamide
SMILESCCC(C)CC(=O)Nc1ccc(C)cc1C
InChIInChI=1S/C14H21NO/c1-5-10(2)9-14(16)15-13-7-6-11(3)8-12(13)4/h6-8,10H,5,9H2,1-4H3,(H,15,16)
InChIKeyZSWMMZMXRSEWBN-UHFFFAOYSA-N
XLogP3.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2,4-dimethylphenyl)-3-methylpentanamide 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

N-(2-amino-4-methylphenyl)-3-methylpentanamide
CID 114873461
N-(2,4-dimethylphenyl)-4-methylpentanamide
CID 78775203
N-[2-(3-hydroxyprop-1-ynyl)-5-methylphenyl]-3-methylpentanamide
CID 114875840
5-(2,5-dimethylanilino)-3-methyl-5-oxopentanoic acid
CID 62965721
(2S)-2-[[2-(2,4-dimethylanilino)-2-oxoethyl]amino]propanoic acid
CID 83194479
3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide
CID 24693280
2-(diethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 28447
(3R)-N-(2,4-dimethylphenyl)-3-pyrazol-1-ylbutanamide
CID 92708020
4-(2-butanoylhydrazinyl)-N-(2,4-dimethylphenyl)-4-oxobutanamide
CID 5199281
N-[2-(2,4-dimethylanilino)-2-oxoethyl]butanamide
CID 47205616
N,N'-bis(2,4-dimethylphenyl)oxamide
CID 3416969
4-amino-N-(4-fluoro-2-methylphenyl)-3-methylbutanamide
CID 81070633

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-3-methylpentanamide?
The IUPAC name of N-(2,4-dimethylphenyl)-3-methylpentanamide (CID 54564506) is N-(2,4-dimethylphenyl)-3-methylpentanamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-3-methylpentanamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-3-methylpentanamide is CCC(C)CC(=O)Nc1ccc(C)cc1C.
What is the InChIKey of N-(2,4-dimethylphenyl)-3-methylpentanamide?
The InChIKey is ZSWMMZMXRSEWBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-5-10(2)9-14(16)15-13-7-6-11(3)8-12(13)4/h6-8,10H,5,9H2,1-4H3,(H,15,16).
What are the key properties of N-(2,4-dimethylphenyl)-3-methylpentanamide?
N-(2,4-dimethylphenyl)-3-methylpentanamide has a molecular weight of 219.33 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-3-methylpentanamide is sourced from PubChem (CID 54564506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).