3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride

C18H23ClN2O — CID 119673932

IUPAC3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
SMILESCc1cc(C)cc(NC(=O)C(C)C(N)c2ccccc2)c1.Cl
InChIInChI=1S/C18H22N2O.ClH/c1-12-9-13(2)11-16(10-12)20-18(21)14(3)17(19)15-7-5-4-6-8-15;/h4-11,14,17H,19H2,1-3H3,(H,20,21);1H
InChIKeyLESVEWMYIFDQIY-UHFFFAOYSA-N
MW318.85 g/mol
LogP4.00
Rot. Bonds4

About 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride

3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride (PubChem CID 119673932) has the molecular formula C18H23ClN2O and a molecular weight of 318.85 g/mol. Its IUPAC name is 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
PubChem CID119673932
Molecular FormulaC18H23ClN2O
Molecular Weight318.85 g/mol
Exact Mass318.15
IUPAC Name3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
SMILESCc1cc(C)cc(NC(=O)C(C)C(N)c2ccccc2)c1.Cl
InChIInChI=1S/C18H22N2O.ClH/c1-12-9-13(2)11-16(10-12)20-18(21)14(3)17(19)15-7-5-4-6-8-15;/h4-11,14,17H,19H2,1-3H3,(H,20,21);1H
InChIKeyLESVEWMYIFDQIY-UHFFFAOYSA-N
XLogP4.00
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.85
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride 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-amino-N-(3,5-dimethylphenyl)-2-phenylacetamide
CID 24701080
3-amino-N-(3,5-dimethoxyphenyl)-2-methyl-3-phenylpropanamide
CID 119673892
3-amino-N-(2-bromo-5-methylphenyl)-2-methyl-3-phenylpropanamide
CID 82747385
3-amino-N-(3-hydroxy-4-methylphenyl)-2-methyl-3-phenylpropanamide
CID 107701634
2-cyano-N-(3,5-dimethylphenyl)-2-phenylacetamide
CID 62878043
3-amino-N-(2,3-dihydro-1H-inden-5-yl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119678167
3-amino-N-(4-ethylphenyl)-2-methyl-3-phenylpropanamide
CID 80546370
3-amino-2-methyl-3-phenyl-N-(1-phenylethyl)propanamide;hydrochloride
CID 119669700
3-amino-N-(2,5-dichlorophenyl)-2-methyl-3-phenylpropanamide
CID 80546727
3-amino-N-(3-ethylphenyl)-2-methyl-3-phenylpropanamide
CID 80546422
3-amino-N-(3,4-dimethoxyphenyl)-2-methyl-3-phenylpropanamide
CID 119673644
3-amino-N-[2-(methanesulfonamido)-5-methylphenyl]-2-methyl-3-phenylpropanamide;hydrochloride
CID 119802640

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
The IUPAC name of 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride (CID 119673932) is 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride is Cc1cc(C)cc(NC(=O)C(C)C(N)c2ccccc2)c1.Cl.
What is the InChIKey of 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
The InChIKey is LESVEWMYIFDQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O.ClH/c1-12-9-13(2)11-16(10-12)20-18(21)14(3)17(19)15-7-5-4-6-8-15;/h4-11,14,17H,19H2,1-3H3,(H,20,21);1H.
What are the key properties of 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride?
3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride has a molecular weight of 318.85 g/mol, XLogP of 4.00, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride is sourced from PubChem (CID 119673932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).