2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile

C12H10N2O2 — CID 114766756

IUPAC2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(OCc2ccco2)n1
InChIInChI=1S/C12H10N2O2/c1-9-5-10(7-13)6-12(14-9)16-8-11-3-2-4-15-11/h2-6H,8H2,1H3
InChIKeyJGMDQYAITXWOCI-UHFFFAOYSA-N
MW214.22 g/mol
LogP2.43
Rot. Bonds3

About 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile

2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile (PubChem CID 114766756) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile.

Molecular Properties

Compound Name2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile
PubChem CID114766756
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(OCc2ccco2)n1
InChIInChI=1S/C12H10N2O2/c1-9-5-10(7-13)6-12(14-9)16-8-11-3-2-4-15-11/h2-6H,8H2,1H3
InChIKeyJGMDQYAITXWOCI-UHFFFAOYSA-N
XLogP2.43
TPSA59.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile?
The IUPAC name of 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile (CID 114766756) is 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile.
What is the SMILES notation for 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile?
The canonical SMILES for 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile is Cc1cc(C#N)cc(OCc2ccco2)n1.
What is the InChIKey of 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile?
The InChIKey is JGMDQYAITXWOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c1-9-5-10(7-13)6-12(14-9)16-8-11-3-2-4-15-11/h2-6H,8H2,1H3.
What are the key properties of 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile?
2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile has a molecular weight of 214.22 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile is sourced from PubChem (CID 114766756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).