3-hydroxy-5-methoxypyridine-2-carbonitrile

C7H6N2O2 — CID 130776778

IUPAC3-hydroxy-5-methoxypyridine-2-carbonitrile
SMILESCOc1cnc(C#N)c(O)c1
InChIInChI=1S/C7H6N2O2/c1-11-5-2-7(10)6(3-8)9-4-5/h2,4,10H,1H3
InChIKeyHZIWKEACNYQWSC-UHFFFAOYSA-N
MW150.14 g/mol
LogP0.67
Rot. Bonds1

About 3-hydroxy-5-methoxypyridine-2-carbonitrile

3-hydroxy-5-methoxypyridine-2-carbonitrile (PubChem CID 130776778) has the molecular formula C7H6N2O2 and a molecular weight of 150.14 g/mol. Its IUPAC name is 3-hydroxy-5-methoxypyridine-2-carbonitrile.

Molecular Properties

Compound Name3-hydroxy-5-methoxypyridine-2-carbonitrile
PubChem CID130776778
Molecular FormulaC7H6N2O2
Molecular Weight150.14 g/mol
Exact Mass150.04
IUPAC Name3-hydroxy-5-methoxypyridine-2-carbonitrile
SMILESCOc1cnc(C#N)c(O)c1
InChIInChI=1S/C7H6N2O2/c1-11-5-2-7(10)6(3-8)9-4-5/h2,4,10H,1H3
InChIKeyHZIWKEACNYQWSC-UHFFFAOYSA-N
XLogP0.67
TPSA66.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-5-methoxypyridine-2-carbonitrile?
The IUPAC name of 3-hydroxy-5-methoxypyridine-2-carbonitrile (CID 130776778) is 3-hydroxy-5-methoxypyridine-2-carbonitrile.
What is the SMILES notation for 3-hydroxy-5-methoxypyridine-2-carbonitrile?
The canonical SMILES for 3-hydroxy-5-methoxypyridine-2-carbonitrile is COc1cnc(C#N)c(O)c1.
What is the InChIKey of 3-hydroxy-5-methoxypyridine-2-carbonitrile?
The InChIKey is HZIWKEACNYQWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2/c1-11-5-2-7(10)6(3-8)9-4-5/h2,4,10H,1H3.
What are the key properties of 3-hydroxy-5-methoxypyridine-2-carbonitrile?
3-hydroxy-5-methoxypyridine-2-carbonitrile has a molecular weight of 150.14 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-5-methoxypyridine-2-carbonitrile is sourced from PubChem (CID 130776778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).