3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide

C17H20N2O — CID 24693280

IUPAC3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide
SMILESCc1ccc(NC(=O)CC(N)c2ccccc2)c(C)c1
InChIInChI=1S/C17H20N2O/c1-12-8-9-16(13(2)10-12)19-17(20)11-15(18)14-6-4-3-5-7-14/h3-10,15H,11,18H2,1-2H3,(H,19,20)
InChIKeyCIZNAIKEAKGXGX-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.33
Rot. Bonds4

About 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide

3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide (PubChem CID 24693280) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide
PubChem CID24693280
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide
SMILESCc1ccc(NC(=O)CC(N)c2ccccc2)c(C)c1
InChIInChI=1S/C17H20N2O/c1-12-8-9-16(13(2)10-12)19-17(20)11-15(18)14-6-4-3-5-7-14/h3-10,15H,11,18H2,1-2H3,(H,19,20)
InChIKeyCIZNAIKEAKGXGX-UHFFFAOYSA-N
XLogP3.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2-fluoro-4-methylphenyl)-3-phenylpropanamide
CID 43114261
3-amino-N-(2-methyl-4-propoxyphenyl)-3-phenylpropanamide
CID 119950312
N-[2-(2,4-dimethylanilino)-2-oxoethyl]-3,3-diphenylpropanamide
CID 112996368
3-amino-N-[(2,4-dimethylphenyl)methyl]-3-phenylpropanamide
CID 119949663
3-amino-N-(2,6-dimethyl-3-pyridinyl)-3-phenylpropanamide;dihydrochloride
CID 119953282
3-amino-N-(2-hydroxy-4-methoxyphenyl)-3-phenylpropanamide
CID 102695385
N-[3-[(3-amino-3-phenylpropanoyl)amino]-4-methylphenyl]-2-methylpropanamide
CID 119949941
[2-(2,4-dimethylanilino)-2-oxoethyl]-[(1S)-2-methyl-1-phenylpropyl]azanium
CID 9131700
3-amino-N-(2-chlorophenyl)-3-phenylpropanamide
CID 24695343
N-(2,4-dimethylphenyl)-3-methylpentanamide
CID 54564506
3-amino-N-[5-[(dimethylamino)methyl]-2-methylphenyl]-3-phenylpropanamide;dihydrochloride
CID 119954106
N-(2,4-dimethylphenyl)-2-phenylbutanamide
CID 2886746

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide?
The IUPAC name of 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide (CID 24693280) is 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide is Cc1ccc(NC(=O)CC(N)c2ccccc2)c(C)c1.
What is the InChIKey of 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide?
The InChIKey is CIZNAIKEAKGXGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-8-9-16(13(2)10-12)19-17(20)11-15(18)14-6-4-3-5-7-14/h3-10,15H,11,18H2,1-2H3,(H,19,20).
What are the key properties of 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide?
3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide has a molecular weight of 268.36 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,4-dimethylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 24693280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).