3-amino-5-chloro-1H-pyridin-2-one;hydrochloride

C5H6Cl2N2O — CID 53217435

IUPAC3-amino-5-chloro-1H-pyridin-2-one;hydrochloride
SMILESCl.Nc1cc(Cl)c[nH]c1=O
InChIInChI=1S/C5H5ClN2O.ClH/c6-3-1-4(7)5(9)8-2-3;/h1-2H,7H2,(H,8,9);1H
InChIKeyUIJBMVGLKKCQFX-UHFFFAOYSA-N
MW181.02 g/mol
LogP1.03
Rot. Bonds

About 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride

3-amino-5-chloro-1H-pyridin-2-one;hydrochloride (PubChem CID 53217435) has the molecular formula C5H6Cl2N2O and a molecular weight of 181.02 g/mol. Its IUPAC name is 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride.

Molecular Properties

Compound Name3-amino-5-chloro-1H-pyridin-2-one;hydrochloride
PubChem CID53217435
Molecular FormulaC5H6Cl2N2O
Molecular Weight181.02 g/mol
Exact Mass179.99
IUPAC Name3-amino-5-chloro-1H-pyridin-2-one;hydrochloride
SMILESCl.Nc1cc(Cl)c[nH]c1=O
InChIInChI=1S/C5H5ClN2O.ClH/c6-3-1-4(7)5(9)8-2-3;/h1-2H,7H2,(H,8,9);1H
InChIKeyUIJBMVGLKKCQFX-UHFFFAOYSA-N
XLogP1.03
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.02
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-5-chloro-1H-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

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride?
The IUPAC name of 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride (CID 53217435) is 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride.
What is the SMILES notation for 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride?
The canonical SMILES for 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride is Cl.Nc1cc(Cl)c[nH]c1=O.
What is the InChIKey of 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride?
The InChIKey is UIJBMVGLKKCQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClN2O.ClH/c6-3-1-4(7)5(9)8-2-3;/h1-2H,7H2,(H,8,9);1H.
What are the key properties of 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride?
3-amino-5-chloro-1H-pyridin-2-one;hydrochloride has a molecular weight of 181.02 g/mol, XLogP of 1.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-chloro-1H-pyridin-2-one;hydrochloride is sourced from PubChem (CID 53217435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).