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

C14H21NO — CID 78775203

IUPACN-(2,4-dimethylphenyl)-4-methylpentanamide
SMILESCc1ccc(NC(=O)CCC(C)C)c(C)c1
InChIInChI=1S/C14H21NO/c1-10(2)5-8-14(16)15-13-7-6-11(3)9-12(13)4/h6-7,9-10H,5,8H2,1-4H3,(H,15,16)
InChIKeyOCRMUGMXSRJBCN-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.68
Rot. Bonds4

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

N-(2,4-dimethylphenyl)-4-methylpentanamide (PubChem CID 78775203) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-4-methylpentanamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-4-methylpentanamide
PubChem CID78775203
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-(2,4-dimethylphenyl)-4-methylpentanamide
SMILESCc1ccc(NC(=O)CCC(C)C)c(C)c1
InChIInChI=1S/C14H21NO/c1-10(2)5-8-14(16)15-13-7-6-11(3)9-12(13)4/h6-7,9-10H,5,8H2,1-4H3,(H,15,16)
InChIKeyOCRMUGMXSRJBCN-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

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Related Compounds

3-[acetyl(2-methylpropyl)amino]-N-(2,4-dimethylphenyl)propanamide
CID 113116006
3-amino-N-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 50944164
4-(2-butanoylhydrazinyl)-N-(2,4-dimethylphenyl)-4-oxobutanamide
CID 5199281
N-(2,4-dimethylphenyl)-3-methylpentanamide
CID 54564506
N-(2,5-dimethylphenyl)-3-(3-methylbutylamino)propanamide
CID 109032011
N-(2,4-dimethylphenyl)-3-(propylamino)propanamide
CID 109011557
(2S)-2-[[2-(2,4-dimethylanilino)-2-oxoethyl]amino]propanoic acid
CID 83194479
N-(2,4-dimethylphenyl)-3-sulfamoylpropanamide
CID 167944439
5-amino-N-(2,5-dimethylphenyl)-4-methylpentanamide
CID 82683861
N-[2-(2,4-dimethylanilino)-2-oxoethyl]butanamide
CID 47205616
N,N'-bis(2,4-dimethylphenyl)oxamide
CID 3416969
N-[2-(3-hydroxyprop-1-ynyl)-5-methylphenyl]-4-methylpentanamide
CID 82766423

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-4-methylpentanamide?
The IUPAC name of N-(2,4-dimethylphenyl)-4-methylpentanamide (CID 78775203) is N-(2,4-dimethylphenyl)-4-methylpentanamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-4-methylpentanamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-4-methylpentanamide is Cc1ccc(NC(=O)CCC(C)C)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-4-methylpentanamide?
The InChIKey is OCRMUGMXSRJBCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)5-8-14(16)15-13-7-6-11(3)9-12(13)4/h6-7,9-10H,5,8H2,1-4H3,(H,15,16).
What are the key properties of N-(2,4-dimethylphenyl)-4-methylpentanamide?
N-(2,4-dimethylphenyl)-4-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)-4-methylpentanamide is sourced from PubChem (CID 78775203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).