2-cyclopentyloxy-6-methylpyridine-4-carbonitrile

C12H14N2O — CID 114766754

IUPAC2-cyclopentyloxy-6-methylpyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(OC2CCCC2)n1
InChIInChI=1S/C12H14N2O/c1-9-6-10(8-13)7-12(14-9)15-11-4-2-3-5-11/h6-7,11H,2-5H2,1H3
InChIKeyVDLWNPRWJSAXKO-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.58
Rot. Bonds2

About 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile

2-cyclopentyloxy-6-methylpyridine-4-carbonitrile (PubChem CID 114766754) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile.

Molecular Properties

Compound Name2-cyclopentyloxy-6-methylpyridine-4-carbonitrile
PubChem CID114766754
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-cyclopentyloxy-6-methylpyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(OC2CCCC2)n1
InChIInChI=1S/C12H14N2O/c1-9-6-10(8-13)7-12(14-9)15-11-4-2-3-5-11/h6-7,11H,2-5H2,1H3
InChIKeyVDLWNPRWJSAXKO-UHFFFAOYSA-N
XLogP2.58
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclobutyloxy-2,6-dimethylpyrimidine
CID 126953843
4-[(4-cyclohexyloxy-6-methylpyrimidin-2-yl)amino]benzonitrile
CID 57399276
2-cycloheptyloxypyridine-4-carbonitrile
CID 61071944
2-chloro-6-(4-methylcyclohexyl)oxypyridine-4-carbonitrile
CID 83073499
2-cyclobutyloxypyridine-4-carbonitrile
CID 62140074
2-methyl-6-(piperidin-4-ylmethoxy)pyridine-4-carbonitrile;hydrochloride
CID 158177882
2-methyl-6-[[4-(methylamino)cyclohexyl]amino]pyridine-4-carbonitrile
CID 114770152
(4-cycloheptyloxy-6-methylpyrimidin-2-yl)hydrazine
CID 80920357
2-methyl-6-(piperidin-4-ylamino)pyridine-4-carbonitrile
CID 114769931
2-[(4-aminocyclohexyl)amino]-6-methylpyridine-4-carbonitrile
CID 114768292
3-(2,6-dimethylpyrimidin-4-yl)oxycyclohexan-1-amine
CID 79465433
4-cyclopentyloxy-3-methylbenzonitrile
CID 60929177

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile?
The IUPAC name of 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile (CID 114766754) is 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile.
What is the SMILES notation for 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile?
The canonical SMILES for 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile is Cc1cc(C#N)cc(OC2CCCC2)n1.
What is the InChIKey of 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile?
The InChIKey is VDLWNPRWJSAXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9-6-10(8-13)7-12(14-9)15-11-4-2-3-5-11/h6-7,11H,2-5H2,1H3.
What are the key properties of 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile?
2-cyclopentyloxy-6-methylpyridine-4-carbonitrile has a molecular weight of 202.26 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-6-methylpyridine-4-carbonitrile is sourced from PubChem (CID 114766754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).