3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide

C17H20N2O — CID 28713899

IUPAC3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide
SMILESCCN(C(=O)CCc1ccccc1N)c1ccccc1
InChIInChI=1S/C17H20N2O/c1-2-19(15-9-4-3-5-10-15)17(20)13-12-14-8-6-7-11-16(14)18/h3-11H,2,12-13,18H2,1H3
InChIKeyGVIQHDDGINZVGE-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.25
Rot. Bonds5

About 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide

3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide (PubChem CID 28713899) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide.

Molecular Properties

Compound Name3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide
PubChem CID28713899
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide
SMILESCCN(C(=O)CCc1ccccc1N)c1ccccc1
InChIInChI=1S/C17H20N2O/c1-2-19(15-9-4-3-5-10-15)17(20)13-12-14-8-6-7-11-16(14)18/h3-11H,2,12-13,18H2,1H3
InChIKeyGVIQHDDGINZVGE-UHFFFAOYSA-N
XLogP3.25
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide 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

3-(2-aminophenyl)-N-(3,5-dimethylphenyl)-N-ethylpropanamide
CID 120609604
3-(2-aminophenyl)-N-methyl-N-phenylpropanamide
CID 28713868
3-(2-aminophenyl)-N-ethyl-N-propylpropanamide
CID 43309247
3-[3-amino-4-(diethylamino)phenyl]-N-ethyl-N-phenylpropanamide
CID 39131020
N-(2-aminophenyl)-N-ethyl-3-(2-methylphenyl)propanamide
CID 62365327
4-amino-N-ethyl-N-phenylbutanamide;hydrochloride
CID 119261842
3-[3-(2-aminophenyl)propanoyl-methylamino]propanoic acid
CID 107273041
4-[3-(N-ethylanilino)-3-oxopropyl]benzoic acid
CID 82071678
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
3-(2-aminophenyl)-N-cyclopentyl-N-ethylpropanamide
CID 43541570
3-(2-aminophenyl)-N-ethyl-N-(4-methyl-1,3-thiazol-2-yl)propanamide;hydrochloride
CID 120611119
3-(2-aminophenyl)-N-(cyclopropylmethyl)-N-ethylpropanamide
CID 63957099

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide?
The IUPAC name of 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide (CID 28713899) is 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide.
What is the SMILES notation for 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide?
The canonical SMILES for 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide is CCN(C(=O)CCc1ccccc1N)c1ccccc1.
What is the InChIKey of 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide?
The InChIKey is GVIQHDDGINZVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-19(15-9-4-3-5-10-15)17(20)13-12-14-8-6-7-11-16(14)18/h3-11H,2,12-13,18H2,1H3.
What are the key properties of 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide?
3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide has a molecular weight of 268.36 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenyl)-N-ethyl-N-phenylpropanamide is sourced from PubChem (CID 28713899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).