6-methyl-4-phenylmethoxypyridine-2-carbonitrile

C14H12N2O — CID 130671911

IUPAC6-methyl-4-phenylmethoxypyridine-2-carbonitrile
SMILESCc1cc(OCc2ccccc2)cc(C#N)n1
InChIInChI=1S/C14H12N2O/c1-11-7-14(8-13(9-15)16-11)17-10-12-5-3-2-4-6-12/h2-8H,10H2,1H3
InChIKeyGPVWRBIMVCQBHO-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.84
Rot. Bonds3

About 6-methyl-4-phenylmethoxypyridine-2-carbonitrile

6-methyl-4-phenylmethoxypyridine-2-carbonitrile (PubChem CID 130671911) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-methyl-4-phenylmethoxypyridine-2-carbonitrile.

Molecular Properties

Compound Name6-methyl-4-phenylmethoxypyridine-2-carbonitrile
PubChem CID130671911
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name6-methyl-4-phenylmethoxypyridine-2-carbonitrile
SMILESCc1cc(OCc2ccccc2)cc(C#N)n1
InChIInChI=1S/C14H12N2O/c1-11-7-14(8-13(9-15)16-11)17-10-12-5-3-2-4-6-12/h2-8H,10H2,1H3
InChIKeyGPVWRBIMVCQBHO-UHFFFAOYSA-N
XLogP2.84
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-6-phenylmethoxyquinoline-4-carbonitrile
CID 82573318
4-methyl-6-phenylmethoxyquinoline-2-carbonitrile
CID 82573287
5-phenylmethoxypyridine-2-carbonitrile
CID 15574701
2-methyl-6-phenylmethoxyquinoline
CID 82580854
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
2-[(4-methoxyphenyl)methoxy]-4,6-dimethylpyridine-3-carbonitrile
CID 61177256
ethane;4-[[3-(phenoxymethyl)phenyl]methoxy]benzonitrile
CID 91060810
1,3-bis[[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]-5-methylbenzene
CID 102395902
2,4-diamino-6-(2,6-dimethyl-4-phenylmethoxyphenyl)pyrimidine-5-carbonitrile
CID 169398835
2-methyl-6-phenylmethoxyquinoline-4-carbothioamide
CID 82574282
2-methyl-4-phenylmethoxybenzenethiol
CID 142266616
3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine
CID 15171436

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-phenylmethoxypyridine-2-carbonitrile?
The IUPAC name of 6-methyl-4-phenylmethoxypyridine-2-carbonitrile (CID 130671911) is 6-methyl-4-phenylmethoxypyridine-2-carbonitrile.
What is the SMILES notation for 6-methyl-4-phenylmethoxypyridine-2-carbonitrile?
The canonical SMILES for 6-methyl-4-phenylmethoxypyridine-2-carbonitrile is Cc1cc(OCc2ccccc2)cc(C#N)n1.
What is the InChIKey of 6-methyl-4-phenylmethoxypyridine-2-carbonitrile?
The InChIKey is GPVWRBIMVCQBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-11-7-14(8-13(9-15)16-11)17-10-12-5-3-2-4-6-12/h2-8H,10H2,1H3.
What are the key properties of 6-methyl-4-phenylmethoxypyridine-2-carbonitrile?
6-methyl-4-phenylmethoxypyridine-2-carbonitrile has a molecular weight of 224.26 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-phenylmethoxypyridine-2-carbonitrile is sourced from PubChem (CID 130671911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).