2,4-dimethyl-N-(4-methylphenyl)pentanamide

C14H21NO — CID 170275837

IUPAC2,4-dimethyl-N-(4-methylphenyl)pentanamide
SMILESCc1ccc(NC(=O)C(C)CC(C)C)cc1
InChIInChI=1S/C14H21NO/c1-10(2)9-12(4)14(16)15-13-7-5-11(3)6-8-13/h5-8,10,12H,9H2,1-4H3,(H,15,16)
InChIKeyWQYZMRTXXWMSDW-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.62
Rot. Bonds4

About 2,4-dimethyl-N-(4-methylphenyl)pentanamide

2,4-dimethyl-N-(4-methylphenyl)pentanamide (PubChem CID 170275837) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2,4-dimethyl-N-(4-methylphenyl)pentanamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(4-methylphenyl)pentanamide
PubChem CID170275837
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2,4-dimethyl-N-(4-methylphenyl)pentanamide
SMILESCc1ccc(NC(=O)C(C)CC(C)C)cc1
InChIInChI=1S/C14H21NO/c1-10(2)9-12(4)14(16)15-13-7-5-11(3)6-8-13/h5-8,10,12H,9H2,1-4H3,(H,15,16)
InChIKeyWQYZMRTXXWMSDW-UHFFFAOYSA-N
XLogP3.62
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 ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,4-dimethyl-N-(4-methylphenyl)pentanamide 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

(2S)-2-(carbamoylamino)-4-methyl-N-(4-methylphenyl)pentanamide
CID 7910463
3-cyano-2-methyl-N-(4-methylphenyl)propanamide
CID 82112482
4-methyl-N-(4-methylphenyl)-2-pyrrol-1-ylpentanamide
CID 3506875
(2S)-2,4-dimethyl-N-naphthalen-2-ylpentanamide
CID 58642005
2,4-diacetyl-N,N'-bis(4-methylphenyl)pentanediamide
CID 4227620
4-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]benzamide
CID 43007121
2,4-dichloro-N-[4-methyl-1-(4-methylanilino)-1-oxopentan-2-yl]benzamide
CID 18205011
methyl 4-[[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]benzoate
CID 7965936
2-(ethylamino)-N-(4-methylphenyl)propanamide
CID 3808367
2-bromo-3-methyl-N-(4-methylphenyl)butanamide
CID 24690960
2-(diethylamino)-N-(4-methylphenyl)propanamide
CID 24843836
[(2R)-3-hydroxy-1-(4-methylanilino)-1-oxopropan-2-yl]carbamic acid
CID 90743753

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(4-methylphenyl)pentanamide?
The IUPAC name of 2,4-dimethyl-N-(4-methylphenyl)pentanamide (CID 170275837) is 2,4-dimethyl-N-(4-methylphenyl)pentanamide.
What is the SMILES notation for 2,4-dimethyl-N-(4-methylphenyl)pentanamide?
The canonical SMILES for 2,4-dimethyl-N-(4-methylphenyl)pentanamide is Cc1ccc(NC(=O)C(C)CC(C)C)cc1.
What is the InChIKey of 2,4-dimethyl-N-(4-methylphenyl)pentanamide?
The InChIKey is WQYZMRTXXWMSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)9-12(4)14(16)15-13-7-5-11(3)6-8-13/h5-8,10,12H,9H2,1-4H3,(H,15,16).
What are the key properties of 2,4-dimethyl-N-(4-methylphenyl)pentanamide?
2,4-dimethyl-N-(4-methylphenyl)pentanamide has a molecular weight of 219.33 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(4-methylphenyl)pentanamide is sourced from PubChem (CID 170275837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).