4-aminopyridin-3-ol;hydrochloride

C5H7ClN2O — CID 22832066

IUPAC4-aminopyridin-3-ol;hydrochloride
SMILESCl.Nc1ccncc1O
InChIInChI=1S/C5H6N2O.ClH/c6-4-1-2-7-3-5(4)8;/h1-3,8H,(H2,6,7);1H
InChIKeyKBMSTKGEAGODPN-UHFFFAOYSA-N
MW146.58 g/mol
LogP0.79
Rot. Bonds

About 4-aminopyridin-3-ol;hydrochloride

4-aminopyridin-3-ol;hydrochloride (PubChem CID 22832066) has the molecular formula C5H7ClN2O and a molecular weight of 146.58 g/mol. Its IUPAC name is 4-aminopyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name4-aminopyridin-3-ol;hydrochloride
PubChem CID22832066
Molecular FormulaC5H7ClN2O
Molecular Weight146.58 g/mol
Exact Mass146.02
IUPAC Name4-aminopyridin-3-ol;hydrochloride
SMILESCl.Nc1ccncc1O
InChIInChI=1S/C5H6N2O.ClH/c6-4-1-2-7-3-5(4)8;/h1-3,8H,(H2,6,7);1H
InChIKeyKBMSTKGEAGODPN-UHFFFAOYSA-N
XLogP0.79
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.58
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-aminopyridin-3-ol;hydrochloride?
The IUPAC name of 4-aminopyridin-3-ol;hydrochloride (CID 22832066) is 4-aminopyridin-3-ol;hydrochloride.
What is the SMILES notation for 4-aminopyridin-3-ol;hydrochloride?
The canonical SMILES for 4-aminopyridin-3-ol;hydrochloride is Cl.Nc1ccncc1O.
What is the InChIKey of 4-aminopyridin-3-ol;hydrochloride?
The InChIKey is KBMSTKGEAGODPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O.ClH/c6-4-1-2-7-3-5(4)8;/h1-3,8H,(H2,6,7);1H.
What are the key properties of 4-aminopyridin-3-ol;hydrochloride?
4-aminopyridin-3-ol;hydrochloride has a molecular weight of 146.58 g/mol, XLogP of 0.79, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminopyridin-3-ol;hydrochloride is sourced from PubChem (CID 22832066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).