2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile

C12H10N2OS — CID 114766908

IUPAC2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(OCc2cccs2)n1
InChIInChI=1S/C12H10N2OS/c1-9-5-10(7-13)6-12(14-9)15-8-11-3-2-4-16-11/h2-6H,8H2,1H3
InChIKeyWKIVXMPWDCEWAW-UHFFFAOYSA-N
MW230.29 g/mol
LogP2.90
Rot. Bonds3

About 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile

2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile (PubChem CID 114766908) has the molecular formula C12H10N2OS and a molecular weight of 230.29 g/mol. Its IUPAC name is 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile
PubChem CID114766908
Molecular FormulaC12H10N2OS
Molecular Weight230.29 g/mol
Exact Mass230.05
IUPAC Name2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(OCc2cccs2)n1
InChIInChI=1S/C12H10N2OS/c1-9-5-10(7-13)6-12(14-9)15-8-11-3-2-4-16-11/h2-6H,8H2,1H3
InChIKeyWKIVXMPWDCEWAW-UHFFFAOYSA-N
XLogP2.90
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-ylmethoxy)-6-methylpyridine-4-carbonitrile
CID 114766756
N,4-dimethyl-6-(thiophen-2-ylmethoxy)pyrimidin-2-amine
CID 80873043
2-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80872816
2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carboximidamide
CID 114769321
6-(thiophen-2-ylmethoxy)pyridine-2-carbonitrile
CID 64594982
2-methyl-6-[2-(methylamino)ethoxy]pyridine-4-carbonitrile
CID 114770421
2-[2-(2-methoxyethoxy)ethoxy]-6-methylpyridine-4-carbonitrile
CID 114766986
2-methyl-6-(piperidin-4-ylmethoxy)pyridine-4-carbonitrile;hydrochloride
CID 158177882
2-(2-ethoxyphenoxy)-6-methylpyridine-4-carbonitrile
CID 114766792
2-methyl-6-pent-4-enoxypyridine-4-carbonitrile
CID 114766957
2-methyl-6-(3-methylbut-3-enoxy)pyridine-4-carbonitrile
CID 114766998
2-tert-butyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80962886

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile?
The IUPAC name of 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile (CID 114766908) is 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile.
What is the SMILES notation for 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile?
The canonical SMILES for 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile is Cc1cc(C#N)cc(OCc2cccs2)n1.
What is the InChIKey of 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile?
The InChIKey is WKIVXMPWDCEWAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2OS/c1-9-5-10(7-13)6-12(14-9)15-8-11-3-2-4-16-11/h2-6H,8H2,1H3.
What are the key properties of 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile?
2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile has a molecular weight of 230.29 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(thiophen-2-ylmethoxy)pyridine-4-carbonitrile is sourced from PubChem (CID 114766908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).