2-benzyl-4-pyridin-2-ylbenzonitrile

C19H14N2 — CID 162707729

IUPAC2-benzyl-4-pyridin-2-ylbenzonitrile
SMILESN#Cc1ccc(-c2ccccn2)cc1Cc1ccccc1
InChIInChI=1S/C19H14N2/c20-14-17-10-9-16(19-8-4-5-11-21-19)13-18(17)12-15-6-2-1-3-7-15/h1-11,13H,12H2
InChIKeyQMMDBUMVZDXUCW-UHFFFAOYSA-N
MW270.33 g/mol
LogP4.21
Rot. Bonds3

About 2-benzyl-4-pyridin-2-ylbenzonitrile

2-benzyl-4-pyridin-2-ylbenzonitrile (PubChem CID 162707729) has the molecular formula C19H14N2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-benzyl-4-pyridin-2-ylbenzonitrile.

Molecular Properties

Compound Name2-benzyl-4-pyridin-2-ylbenzonitrile
PubChem CID162707729
Molecular FormulaC19H14N2
Molecular Weight270.33 g/mol
Exact Mass270.12
IUPAC Name2-benzyl-4-pyridin-2-ylbenzonitrile
SMILESN#Cc1ccc(-c2ccccn2)cc1Cc1ccccc1
InChIInChI=1S/C19H14N2/c20-14-17-10-9-16(19-8-4-5-11-21-19)13-18(17)12-15-6-2-1-3-7-15/h1-11,13H,12H2
InChIKeyQMMDBUMVZDXUCW-UHFFFAOYSA-N
XLogP4.21
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-pyridin-2-ylphenyl)benzene-1,2,3-tricarbonitrile
CID 126496802
2-(3-pyridin-2-ylphenyl)benzene-1,3-dicarbonitrile
CID 126496742
4-benzyl-3,6-dipyridin-2-ylpyridazine
CID 132577194
2-[3-[dideuterio(phenyl)methyl]-4-(trideuteriomethyl)phenyl]pyridine
CID 162707478
2-(4-benzyl-5-phenyl-1H-pyrrol-2-yl)pyridine
CID 166446555
4-(4-benzyl-2-pyridinyl)benzonitrile
CID 162708682
2-benzyl-6-[6-(3-pyridin-2-ylphenyl)-2-pyridinyl]phenol
CID 164742350
3-phenyl-5-(3-pyridin-2-ylphenyl)benzonitrile
CID 90393137
2-[3-[4-[4-[3-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
CID 171461302
3-benzyl-2-chloropyridine
CID 22768075
2-[(Z)-2-[3-[2-(2-phenyl-4-pyridin-2-ylphenyl)ethenyl]-5-[(Z)-2-(2-phenyl-4-pyridin-2-ylphenyl)ethenyl]phenyl]ethenyl]-5-pyridin-2-ylbenzonitrile
CID 162264077
1-(2-methoxy-5-pyridin-2-ylphenyl)-N-methylmethanamine
CID 63680782

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-pyridin-2-ylbenzonitrile?
The IUPAC name of 2-benzyl-4-pyridin-2-ylbenzonitrile (CID 162707729) is 2-benzyl-4-pyridin-2-ylbenzonitrile.
What is the SMILES notation for 2-benzyl-4-pyridin-2-ylbenzonitrile?
The canonical SMILES for 2-benzyl-4-pyridin-2-ylbenzonitrile is N#Cc1ccc(-c2ccccn2)cc1Cc1ccccc1.
What is the InChIKey of 2-benzyl-4-pyridin-2-ylbenzonitrile?
The InChIKey is QMMDBUMVZDXUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2/c20-14-17-10-9-16(19-8-4-5-11-21-19)13-18(17)12-15-6-2-1-3-7-15/h1-11,13H,12H2.
What are the key properties of 2-benzyl-4-pyridin-2-ylbenzonitrile?
2-benzyl-4-pyridin-2-ylbenzonitrile has a molecular weight of 270.33 g/mol, XLogP of 4.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-pyridin-2-ylbenzonitrile is sourced from PubChem (CID 162707729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).