3-amino-N-(4-phenylphenyl)propanamide;hydrochloride

C15H17ClN2O — CID 44769625

IUPAC3-amino-N-(4-phenylphenyl)propanamide;hydrochloride
SMILESCl.NCCC(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H16N2O.ClH/c16-11-10-15(18)17-14-8-6-13(7-9-14)12-4-2-1-3-5-12;/h1-9H,10-11,16H2,(H,17,18);1H
InChIKeyZYVHBBLYNMCEAK-UHFFFAOYSA-N
MW276.77 g/mol
LogP3.06
Rot. Bonds4

About 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride

3-amino-N-(4-phenylphenyl)propanamide;hydrochloride (PubChem CID 44769625) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(4-phenylphenyl)propanamide;hydrochloride
PubChem CID44769625
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name3-amino-N-(4-phenylphenyl)propanamide;hydrochloride
SMILESCl.NCCC(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H16N2O.ClH/c16-11-10-15(18)17-14-8-6-13(7-9-14)12-4-2-1-3-5-12;/h1-9H,10-11,16H2,(H,17,18);1H
InChIKeyZYVHBBLYNMCEAK-UHFFFAOYSA-N
XLogP3.06
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(4-phenylphenyl)acetamide
CID 43218250
3-amino-N-(4-methylphenyl)propanamide;hydrochloride
CID 15558174
4-hydroxy-N-(4-phenylphenyl)butanamide
CID 79192454
3-amino-N-[4-(3-phenylpropyl)phenyl]propanamide;hydrochloride
CID 119315336
N-(4-acetamidophenyl)-3-aminopropanamide
CID 22692055
3-amino-N-(4-hydroxyphenyl)propanamide
CID 43710647
8-oxo-8-(4-phenylanilino)octanoic acid
CID 23092302
4-bromo-N-(4-phenylphenyl)butanamide
CID 45379211
4-[4-[4-(3-carboxypropanoylamino)phenyl]anilino]-4-oxobutanoic acid
CID 18877617
3-fluoro-N-phenylpropanamide
CID 70366284
3-amino-N-(4-phenylphenyl)butanamide
CID 60835996
3-amino-N-(4-sulfamoylphenyl)propanamide
CID 10776616

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride?
The IUPAC name of 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride (CID 44769625) is 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride is Cl.NCCC(=O)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride?
The InChIKey is ZYVHBBLYNMCEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O.ClH/c16-11-10-15(18)17-14-8-6-13(7-9-14)12-4-2-1-3-5-12;/h1-9H,10-11,16H2,(H,17,18);1H.
What are the key properties of 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride?
3-amino-N-(4-phenylphenyl)propanamide;hydrochloride has a molecular weight of 276.77 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-phenylphenyl)propanamide;hydrochloride is sourced from PubChem (CID 44769625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).