2-(4-aminophenyl)-3-phenylpropanamide

C15H16N2O — CID 82020975

IUPAC2-(4-aminophenyl)-3-phenylpropanamide
SMILESNC(=O)C(Cc1ccccc1)c1ccc(N)cc1
InChIInChI=1S/C15H16N2O/c16-13-8-6-12(7-9-13)14(15(17)18)10-11-4-2-1-3-5-11/h1-9,14H,10,16H2,(H2,17,18)
InChIKeyQGNCGNIDIINNCC-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.08
Rot. Bonds4

About 2-(4-aminophenyl)-3-phenylpropanamide

2-(4-aminophenyl)-3-phenylpropanamide (PubChem CID 82020975) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-(4-aminophenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-3-phenylpropanamide
PubChem CID82020975
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-(4-aminophenyl)-3-phenylpropanamide
SMILESNC(=O)C(Cc1ccccc1)c1ccc(N)cc1
InChIInChI=1S/C15H16N2O/c16-13-8-6-12(7-9-13)14(15(17)18)10-11-4-2-1-3-5-11/h1-9,14H,10,16H2,(H2,17,18)
InChIKeyQGNCGNIDIINNCC-UHFFFAOYSA-N
XLogP2.08
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(6-methyl-3-pyridinyl)-3-phenylpropanamide
CID 69080693
3-(3-methylphenyl)-2-phenylpropanamide
CID 123295994
2-phenyl-3-pyridin-3-ylpropanamide
CID 171502842
(2S)-2,3-diphenylpropanoic acid
CID 737125
(2S)-2-(4-aminophenyl)-3-pyridin-4-ylpropanoic acid
CID 39346452
3-phenyl-2-(1H-pyrazol-4-yl)propanamide
CID 91102712
(2R)-2-(4-aminophenyl)-3-(3-hydroxyphenyl)propanoic acid
CID 124549291
2-(6-cyano-3-pyridinyl)-3-phenylpropanamide
CID 154724655
(2S)-2,3-diphenylpropanoate
CID 6993748
2-naphthalen-1-yl-3-phenylpropanamide
CID 141457606
2-bromo-3-phenylpropanamide
CID 22238787
(2S)-2-bromo-3-phenylpropanamide
CID 71482600

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-3-phenylpropanamide?
The IUPAC name of 2-(4-aminophenyl)-3-phenylpropanamide (CID 82020975) is 2-(4-aminophenyl)-3-phenylpropanamide.
What is the SMILES notation for 2-(4-aminophenyl)-3-phenylpropanamide?
The canonical SMILES for 2-(4-aminophenyl)-3-phenylpropanamide is NC(=O)C(Cc1ccccc1)c1ccc(N)cc1.
What is the InChIKey of 2-(4-aminophenyl)-3-phenylpropanamide?
The InChIKey is QGNCGNIDIINNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c16-13-8-6-12(7-9-13)14(15(17)18)10-11-4-2-1-3-5-11/h1-9,14H,10,16H2,(H2,17,18).
What are the key properties of 2-(4-aminophenyl)-3-phenylpropanamide?
2-(4-aminophenyl)-3-phenylpropanamide has a molecular weight of 240.31 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-3-phenylpropanamide is sourced from PubChem (CID 82020975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).