4-hydroxy-1H-pyridin-2-one;hydrochloride

C5H6ClNO2 — CID 174631763

IUPAC4-hydroxy-1H-pyridin-2-one;hydrochloride
SMILESCl.O=c1cc(O)cc[nH]1
InChIInChI=1S/C5H5NO2.ClH/c7-4-1-2-6-5(8)3-4;/h1-3H,(H2,6,7,8);1H
InChIKeyKDIPYEBZAAHUCZ-UHFFFAOYSA-N
MW147.56 g/mol
LogP0.50
Rot. Bonds

About 4-hydroxy-1H-pyridin-2-one;hydrochloride

4-hydroxy-1H-pyridin-2-one;hydrochloride (PubChem CID 174631763) has the molecular formula C5H6ClNO2 and a molecular weight of 147.56 g/mol. Its IUPAC name is 4-hydroxy-1H-pyridin-2-one;hydrochloride.

Molecular Properties

Compound Name4-hydroxy-1H-pyridin-2-one;hydrochloride
PubChem CID174631763
Molecular FormulaC5H6ClNO2
Molecular Weight147.56 g/mol
Exact Mass147.01
IUPAC Name4-hydroxy-1H-pyridin-2-one;hydrochloride
SMILESCl.O=c1cc(O)cc[nH]1
InChIInChI=1S/C5H5NO2.ClH/c7-4-1-2-6-5(8)3-4;/h1-3H,(H2,6,7,8);1H
InChIKeyKDIPYEBZAAHUCZ-UHFFFAOYSA-N
XLogP0.50
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.56
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Gimeracil
CID 54679224
5-hydroxy-2(1H)-pyridinone
CID 99456
4-Hydroxy-2(1H)-pyridinone
CID 54696004
3-Chloro-4-hydroxypyridin-2(1H)-one
CID 54682528
5-Bromo-4-hydroxy-2(1H)-pyridinone
CID 54734254
Pyridin-2(1H)-one--water (1/1)
CID 22366125
3,4-Dihydroxypyridin-2(1H)-one
CID 54707960
3-Bromo-4-hydroxypyridin-2(1h)-one
CID 54715668
4-Hydroxy-3-iodopyridin-2(1H)-one
CID 54719033
4-Hydroxy-3-methyl-2(1H)-pyridinone
CID 54723665
2,3-Dihydroxypyridine hydrochloride
CID 57468247
Pyridine-2,4,5-triol
CID 87765130

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1H-pyridin-2-one;hydrochloride?
The IUPAC name of 4-hydroxy-1H-pyridin-2-one;hydrochloride (CID 174631763) is 4-hydroxy-1H-pyridin-2-one;hydrochloride.
What is the SMILES notation for 4-hydroxy-1H-pyridin-2-one;hydrochloride?
The canonical SMILES for 4-hydroxy-1H-pyridin-2-one;hydrochloride is Cl.O=c1cc(O)cc[nH]1.
What is the InChIKey of 4-hydroxy-1H-pyridin-2-one;hydrochloride?
The InChIKey is KDIPYEBZAAHUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NO2.ClH/c7-4-1-2-6-5(8)3-4;/h1-3H,(H2,6,7,8);1H.
What are the key properties of 4-hydroxy-1H-pyridin-2-one;hydrochloride?
4-hydroxy-1H-pyridin-2-one;hydrochloride has a molecular weight of 147.56 g/mol, XLogP of 0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1H-pyridin-2-one;hydrochloride is sourced from PubChem (CID 174631763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).