5-phenylmethoxypyridine-2-carbonitrile

C13H10N2O — CID 15574701

IUPAC5-phenylmethoxypyridine-2-carbonitrile
SMILESN#Cc1ccc(OCc2ccccc2)cn1
InChIInChI=1S/C13H10N2O/c14-8-12-6-7-13(9-15-12)16-10-11-4-2-1-3-5-11/h1-7,9H,10H2
InChIKeyFCECYLUEYDBZHV-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.53
Rot. Bonds3

About 5-phenylmethoxypyridine-2-carbonitrile

5-phenylmethoxypyridine-2-carbonitrile (PubChem CID 15574701) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 5-phenylmethoxypyridine-2-carbonitrile.

Molecular Properties

Compound Name5-phenylmethoxypyridine-2-carbonitrile
PubChem CID15574701
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name5-phenylmethoxypyridine-2-carbonitrile
SMILESN#Cc1ccc(OCc2ccccc2)cn1
InChIInChI=1S/C13H10N2O/c14-8-12-6-7-13(9-15-12)16-10-11-4-2-1-3-5-11/h1-7,9H,10H2
InChIKeyFCECYLUEYDBZHV-UHFFFAOYSA-N
XLogP2.53
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-phenylpropoxy)pyridine-2-carbonitrile
CID 113320705
6-methyl-4-phenylmethoxypyridine-2-carbonitrile
CID 130671911
2-iodo-5-phenylmethoxypyrimidine
CID 153056979
5-phenylmethoxypyrimidin-2-amine
CID 20748397
2-methyl-5-phenylmethoxypyrimidine
CID 59993103
5-[(1-phenyl-2-phenylmethoxyethyl)amino]pyridine-2-carbonitrile
CID 133346332
6-phenylmethoxypyrazolo[1,5-a]pyridine-3-carbonitrile
CID 175982897
4-methyl-6-phenylmethoxyquinoline-2-carbonitrile
CID 82573287
2-phenyl-5-phenylmethoxypyrimidine
CID 151774114
4-[(4-phenylphenoxy)methyl]benzonitrile
CID 7919523
5-(2-phenylethylsulfanyl)pyridine-2-carbonitrile
CID 54542104
6-chloro-3-(4-phenylmethoxyphenoxy)pyrazine-2-carbonitrile
CID 22662788

Frequently Asked Questions

What is the IUPAC name of 5-phenylmethoxypyridine-2-carbonitrile?
The IUPAC name of 5-phenylmethoxypyridine-2-carbonitrile (CID 15574701) is 5-phenylmethoxypyridine-2-carbonitrile.
What is the SMILES notation for 5-phenylmethoxypyridine-2-carbonitrile?
The canonical SMILES for 5-phenylmethoxypyridine-2-carbonitrile is N#Cc1ccc(OCc2ccccc2)cn1.
What is the InChIKey of 5-phenylmethoxypyridine-2-carbonitrile?
The InChIKey is FCECYLUEYDBZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c14-8-12-6-7-13(9-15-12)16-10-11-4-2-1-3-5-11/h1-7,9H,10H2.
What are the key properties of 5-phenylmethoxypyridine-2-carbonitrile?
5-phenylmethoxypyridine-2-carbonitrile has a molecular weight of 210.24 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylmethoxypyridine-2-carbonitrile is sourced from PubChem (CID 15574701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).