3-hydroxy-6-methylpyridine-2-carbonitrile

C7H6N2O — CID 45079462

IUPAC3-hydroxy-6-methylpyridine-2-carbonitrile
SMILESCc1ccc(O)c(C#N)n1
InChIInChI=1S/C7H6N2O/c1-5-2-3-7(10)6(4-8)9-5/h2-3,10H,1H3
InChIKeyOCSKXTULVYOUJG-UHFFFAOYSA-N
MW134.14 g/mol
LogP0.97
Rot. Bonds

About 3-hydroxy-6-methylpyridine-2-carbonitrile

3-hydroxy-6-methylpyridine-2-carbonitrile (PubChem CID 45079462) has the molecular formula C7H6N2O and a molecular weight of 134.14 g/mol. Its IUPAC name is 3-hydroxy-6-methylpyridine-2-carbonitrile.

Molecular Properties

Compound Name3-hydroxy-6-methylpyridine-2-carbonitrile
PubChem CID45079462
Molecular FormulaC7H6N2O
Molecular Weight134.14 g/mol
Exact Mass134.05
IUPAC Name3-hydroxy-6-methylpyridine-2-carbonitrile
SMILESCc1ccc(O)c(C#N)n1
InChIInChI=1S/C7H6N2O/c1-5-2-3-7(10)6(4-8)9-5/h2-3,10H,1H3
InChIKeyOCSKXTULVYOUJG-UHFFFAOYSA-N
XLogP0.97
TPSA56.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-6-methylpyridine-2-carbonitrile?
The IUPAC name of 3-hydroxy-6-methylpyridine-2-carbonitrile (CID 45079462) is 3-hydroxy-6-methylpyridine-2-carbonitrile.
What is the SMILES notation for 3-hydroxy-6-methylpyridine-2-carbonitrile?
The canonical SMILES for 3-hydroxy-6-methylpyridine-2-carbonitrile is Cc1ccc(O)c(C#N)n1.
What is the InChIKey of 3-hydroxy-6-methylpyridine-2-carbonitrile?
The InChIKey is OCSKXTULVYOUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O/c1-5-2-3-7(10)6(4-8)9-5/h2-3,10H,1H3.
What are the key properties of 3-hydroxy-6-methylpyridine-2-carbonitrile?
3-hydroxy-6-methylpyridine-2-carbonitrile has a molecular weight of 134.14 g/mol, XLogP of 0.97, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-6-methylpyridine-2-carbonitrile is sourced from PubChem (CID 45079462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).