3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide

C18H22N2O — CID 119950423

IUPAC3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide
SMILESCc1cc(C)cc(N(C)C(=O)CC(N)c2ccccc2)c1
InChIInChI=1S/C18H22N2O/c1-13-9-14(2)11-16(10-13)20(3)18(21)12-17(19)15-7-5-4-6-8-15/h4-11,17H,12,19H2,1-3H3
InChIKeyUEBOMRIFABQBJV-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.36
Rot. Bonds4

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

3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide (PubChem CID 119950423) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide
PubChem CID119950423
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide
SMILESCc1cc(C)cc(N(C)C(=O)CC(N)c2ccccc2)c1
InChIInChI=1S/C18H22N2O/c1-13-9-14(2)11-16(10-13)20(3)18(21)12-17(19)15-7-5-4-6-8-15/h4-11,17H,12,19H2,1-3H3
InChIKeyUEBOMRIFABQBJV-UHFFFAOYSA-N
XLogP3.36
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N,N-dimethyl-3-phenylpropanamide
CID 24691874
3-amino-N-ethyl-N-methyl-3-phenylpropanamide
CID 43263469
2-amino-N-(3,5-dimethylphenyl)-N-methylacetamide
CID 28794396
3-amino-N-butan-2-yl-N-methyl-3-phenylpropanamide;hydrochloride
CID 119950260
3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-phenylpropanamide
CID 43588867
(1R)-1-amino-4-methyl-1-phenylpentan-3-one
CID 58688874
2-amino-N-methyl-N-(3-methylphenyl)-2-phenylacetamide
CID 76931148
4-amino-N-(3,5-dimethylphenyl)-3-methoxy-N-methylbutanamide;hydrochloride
CID 120589892
3-amino-N-(2,2-difluoroethyl)-N-methyl-3-phenylpropanamide;hydrochloride
CID 119950674
3-amino-N-methyl-3-phenyl-N-(2-phenylethyl)propanamide
CID 60947587
3-amino-N-(2,2-dimethylpropyl)-N-methyl-3-phenylpropanamide;hydrochloride
CID 119950369
3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-3-phenylpropanamide
CID 119949182

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide?
The IUPAC name of 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide (CID 119950423) is 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide is Cc1cc(C)cc(N(C)C(=O)CC(N)c2ccccc2)c1.
What is the InChIKey of 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide?
The InChIKey is UEBOMRIFABQBJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-13-9-14(2)11-16(10-13)20(3)18(21)12-17(19)15-7-5-4-6-8-15/h4-11,17H,12,19H2,1-3H3.
What are the key properties of 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide?
3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide has a molecular weight of 282.39 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3,5-dimethylphenyl)-N-methyl-3-phenylpropanamide is sourced from PubChem (CID 119950423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).