1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride

C13H15ClN2O — CID 91662965

IUPAC1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride
SMILESCl.NC(Cn1ccccc1=O)c1ccccc1
InChIInChI=1S/C13H14N2O.ClH/c14-12(11-6-2-1-3-7-11)10-15-9-5-4-8-13(15)16;/h1-9,12H,10,14H2;1H
InChIKeyHIVDXLCLDDKTOI-UHFFFAOYSA-N
MW250.73 g/mol
LogP1.97
Rot. Bonds3

About 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride

1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride (PubChem CID 91662965) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride.

Molecular Properties

Compound Name1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride
PubChem CID91662965
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride
SMILESCl.NC(Cn1ccccc1=O)c1ccccc1
InChIInChI=1S/C13H14N2O.ClH/c14-12(11-6-2-1-3-7-11)10-15-9-5-4-8-13(15)16;/h1-9,12H,10,14H2;1H
InChIKeyHIVDXLCLDDKTOI-UHFFFAOYSA-N
XLogP1.97
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride 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

1-(2-amino-2-phenylethyl)pyridin-2-one
CID 16783269
1-[(2S)-2-hydroxy-2-phenylethyl]pyridin-2-one
CID 36689704
1-(2-amino-2-phenylethyl)-3-bromopyridin-2-one
CID 114760507
4-(2-amino-2-phenylethyl)-1,2,4-triazolidine-3,5-dione
CID 107410015
1-(2-amino-2-phenylethyl)pyrrole-2,5-dione
CID 63120892
2-methyl-3-(2-oxo-1-pyridinyl)propanoic acid
CID 60773689
1-(2-amino-2-cyclopentylethyl)pyridin-2-one
CID 104747056
(1R)-2-(azetidin-1-yl)-1-phenylethanamine
CID 58948538
1-(2-amino-2-phenylethyl)-1,4-diazepan-5-one
CID 63771217
2-(3-fluoroazetidin-1-yl)-1-phenylethanamine;hydrochloride
CID 134586238
N-[(1R)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-3-carboxamide
CID 100735320
cis-(1R,3S)-2,2-dimethyl-3-[[2-(2-oxo-1-pyridinyl)-1-phenylethyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 122066942

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride?
The IUPAC name of 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride (CID 91662965) is 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride.
What is the SMILES notation for 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride?
The canonical SMILES for 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride is Cl.NC(Cn1ccccc1=O)c1ccccc1.
What is the InChIKey of 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride?
The InChIKey is HIVDXLCLDDKTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O.ClH/c14-12(11-6-2-1-3-7-11)10-15-9-5-4-8-13(15)16;/h1-9,12H,10,14H2;1H.
What are the key properties of 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride?
1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride has a molecular weight of 250.73 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-phenylethyl)pyridin-2-one;hydrochloride is sourced from PubChem (CID 91662965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).