3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile

C11H7ClN2O2 — CID 107058734

IUPAC3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile
SMILESN#Cc1ccnc(OCc2ccco2)c1Cl
InChIInChI=1S/C11H7ClN2O2/c12-10-8(6-13)3-4-14-11(10)16-7-9-2-1-5-15-9/h1-5H,7H2
InChIKeyQIYVZBLKBOLDPI-UHFFFAOYSA-N
MW234.64 g/mol
LogP2.78
Rot. Bonds3

About 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile

3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile (PubChem CID 107058734) has the molecular formula C11H7ClN2O2 and a molecular weight of 234.64 g/mol. Its IUPAC name is 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile.

Molecular Properties

Compound Name3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile
PubChem CID107058734
Molecular FormulaC11H7ClN2O2
Molecular Weight234.64 g/mol
Exact Mass234.02
IUPAC Name3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile
SMILESN#Cc1ccnc(OCc2ccco2)c1Cl
InChIInChI=1S/C11H7ClN2O2/c12-10-8(6-13)3-4-14-11(10)16-7-9-2-1-5-15-9/h1-5H,7H2
InChIKeyQIYVZBLKBOLDPI-UHFFFAOYSA-N
XLogP2.78
TPSA59.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.64
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-(furan-2-ylmethoxy)benzonitrile
CID 22661920
3-chloro-2-(2-hydroxyethoxy)pyridine-4-carbonitrile
CID 107058885
2-(furan-2-ylmethoxy)-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 79869558
2-(3-aminopropoxy)-3-chloropyridine-4-carbonitrile
CID 107061653
3-chloro-2-(2-methoxyethoxy)pyridine-4-carbonitrile
CID 107058776
2-(2-aminophenoxy)-3-chloropyridine-4-carbonitrile
CID 107061078
3-bromo-2-(furan-2-ylmethoxy)pyridine
CID 61373376
5-amino-6-(furan-2-ylmethoxy)pyridine-3-carbonitrile
CID 103469423
3-chloro-2-[2-[di(propan-2-yl)amino]ethoxy]pyridine-4-carbonitrile
CID 107059128
3-chloro-2-[2-(dimethylamino)-2-methylpropoxy]pyridine-4-carbonitrile
CID 107059108
3-chloro-2-(2-propoxyphenoxy)pyridine-4-carbonitrile
CID 107058762
3-chloro-2-(piperidin-4-ylmethoxy)pyridine-4-carbonitrile
CID 107061650

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile?
The IUPAC name of 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile (CID 107058734) is 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile.
What is the SMILES notation for 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile?
The canonical SMILES for 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile is N#Cc1ccnc(OCc2ccco2)c1Cl.
What is the InChIKey of 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile?
The InChIKey is QIYVZBLKBOLDPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN2O2/c12-10-8(6-13)3-4-14-11(10)16-7-9-2-1-5-15-9/h1-5H,7H2.
What are the key properties of 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile?
3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile has a molecular weight of 234.64 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(furan-2-ylmethoxy)pyridine-4-carbonitrile is sourced from PubChem (CID 107058734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).