5-hydroxypyridine-3-carbonitrile

C6H4N2O — CID 15342142

IUPAC5-hydroxypyridine-3-carbonitrile
SMILESN#Cc1cncc(O)c1
InChIInChI=1S/C6H4N2O/c7-2-5-1-6(9)4-8-3-5/h1,3-4,9H
InChIKeyKAXIYYPIORYZLB-UHFFFAOYSA-N
MW120.11 g/mol
LogP0.66
Rot. Bonds

About 5-hydroxypyridine-3-carbonitrile

5-hydroxypyridine-3-carbonitrile (PubChem CID 15342142) has the molecular formula C6H4N2O and a molecular weight of 120.11 g/mol. Its IUPAC name is 5-hydroxypyridine-3-carbonitrile.

Molecular Properties

Compound Name5-hydroxypyridine-3-carbonitrile
PubChem CID15342142
Molecular FormulaC6H4N2O
Molecular Weight120.11 g/mol
Exact Mass120.03
IUPAC Name5-hydroxypyridine-3-carbonitrile
SMILESN#Cc1cncc(O)c1
InChIInChI=1S/C6H4N2O/c7-2-5-1-6(9)4-8-3-5/h1,3-4,9H
InChIKeyKAXIYYPIORYZLB-UHFFFAOYSA-N
XLogP0.66
TPSA56.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.11
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-hydroxypyridine-3-carbonitrile 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 5-hydroxypyridine-3-carbonitrile?
The IUPAC name of 5-hydroxypyridine-3-carbonitrile (CID 15342142) is 5-hydroxypyridine-3-carbonitrile.
What is the SMILES notation for 5-hydroxypyridine-3-carbonitrile?
The canonical SMILES for 5-hydroxypyridine-3-carbonitrile is N#Cc1cncc(O)c1.
What is the InChIKey of 5-hydroxypyridine-3-carbonitrile?
The InChIKey is KAXIYYPIORYZLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2O/c7-2-5-1-6(9)4-8-3-5/h1,3-4,9H.
What are the key properties of 5-hydroxypyridine-3-carbonitrile?
5-hydroxypyridine-3-carbonitrile has a molecular weight of 120.11 g/mol, XLogP of 0.66, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxypyridine-3-carbonitrile is sourced from PubChem (CID 15342142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).