N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide

C15H24N2O — CID 119995938

IUPACN-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide
SMILESCc1ccc(CCC(=O)NCC(C)CN)c(C)c1
InChIInChI=1S/C15H24N2O/c1-11-4-5-14(13(3)8-11)6-7-15(18)17-10-12(2)9-16/h4-5,8,12H,6-7,9-10,16H2,1-3H3,(H,17,18)
InChIKeyRIPGDHGRXJFCOE-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.95
Rot. Bonds6

About N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide

N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide (PubChem CID 119995938) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide
PubChem CID119995938
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide
SMILESCc1ccc(CCC(=O)NCC(C)CN)c(C)c1
InChIInChI=1S/C15H24N2O/c1-11-4-5-14(13(3)8-11)6-7-15(18)17-10-12(2)9-16/h4-5,8,12H,6-7,9-10,16H2,1-3H3,(H,17,18)
InChIKeyRIPGDHGRXJFCOE-UHFFFAOYSA-N
XLogP1.95
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide 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-(3-amino-2-methylpropyl)-3-(2,4,5-trimethylphenyl)propanamide
CID 115271746
N-[(2S)-1-aminopropan-2-yl]-3-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 120507266
N-(3-amino-2-methylpropyl)-3-(4-methylphenyl)propanamide;hydrochloride
CID 119995634
3-(2,4-dimethylphenyl)propanehydrazide
CID 116843444
N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)-N-methylpropanamide
CID 115272486
3-[3-(2,4-dimethylphenyl)propanoylamino]-2-phenylpropanoic acid
CID 119254764
N-[2-[(3-amino-2-methylpropyl)amino]-2-oxoethyl]-3-(4-methylphenyl)propanamide;hydrochloride
CID 119997514
3-(2,4-dimethylphenyl)-N-(3-hydroxy-4-methylpentyl)propanamide
CID 111461043
3-(2,4-dimethylphenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]propanamide
CID 78866814
N'-[3-(2,4-dimethylphenyl)propanoyl]-3-methylbutanehydrazide
CID 37012024
N-(3-amino-2-methylpropyl)-3-(2,3,4-trimethoxyphenyl)propanamide
CID 119997065
N-(3-amino-2-methylpropyl)-3-(2-bromo-5-chlorophenyl)propanamide
CID 119995419

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide (CID 119995938) is N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide is Cc1ccc(CCC(=O)NCC(C)CN)c(C)c1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide?
The InChIKey is RIPGDHGRXJFCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11-4-5-14(13(3)8-11)6-7-15(18)17-10-12(2)9-16/h4-5,8,12H,6-7,9-10,16H2,1-3H3,(H,17,18).
What are the key properties of N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide?
N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide has a molecular weight of 248.37 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-3-(2,4-dimethylphenyl)propanamide is sourced from PubChem (CID 119995938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).