4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile

C19H14N2 — CID 168821635

IUPAC4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile
SMILESCc1cnc(-c2ccc(C#N)cc2)cc1-c1ccccc1
InChIInChI=1S/C19H14N2/c1-14-13-21-19(17-9-7-15(12-20)8-10-17)11-18(14)16-5-3-2-4-6-16/h2-11,13H,1H3
InChIKeyROADTBZWOGHTMU-UHFFFAOYSA-N
MW270.34 g/mol
LogP4.60
Rot. Bonds2

About 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile

4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile (PubChem CID 168821635) has the molecular formula C19H14N2 and a molecular weight of 270.34 g/mol. Its IUPAC name is 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile.

Molecular Properties

Compound Name4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile
PubChem CID168821635
Molecular FormulaC19H14N2
Molecular Weight270.34 g/mol
Exact Mass270.12
IUPAC Name4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile
SMILESCc1cnc(-c2ccc(C#N)cc2)cc1-c1ccccc1
InChIInChI=1S/C19H14N2/c1-14-13-21-19(17-9-7-15(12-20)8-10-17)11-18(14)16-5-3-2-4-6-16/h2-11,13H,1H3
InChIKeyROADTBZWOGHTMU-UHFFFAOYSA-N
XLogP4.60
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-4-phenyl-2-(3-phenylphenyl)pyridine
CID 140676048
4-(4,5-dimethyl-2-pyridinyl)-2-phenylbenzonitrile
CID 170284634
5-(4,5-dimethyl-2-pyridinyl)-2-phenylbenzonitrile
CID 70842748
CID 174081662
CID 174081662
5-methyl-2-[6-(5-methyl-4-phenyl-2-pyridinyl)-2-pyridinyl]-4-phenylpyridine
CID 10993350
4-[2-[5-[4-(4-cyanophenyl)-6-phenylpyrimidin-2-yl]naphthalen-1-yl]-6-phenylpyrimidin-4-yl]benzonitrile
CID 122448003
iridium;tris(4-methyl-2,5-diphenylpyridine)
CID 158257140
4-isocyano-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-1,2-dicarbonitrile
CID 168821657
benzonitrile;dichloroplatinum;bis(2,4-dimethyl-N,N-bis[3-(5-methyl-4-naphthalen-2-yl-2-pyridinyl)phenyl]-6-phenylaniline)
CID 159870963
ethane;4-methyl-2-(4-methylphenyl)-5-phenylpyridine
CID 142296902
2,5-dimethyl-4-phenylpyridine
CID 603086
4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzonitrile
CID 102136380

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile?
The IUPAC name of 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile (CID 168821635) is 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile.
What is the SMILES notation for 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile?
The canonical SMILES for 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile is Cc1cnc(-c2ccc(C#N)cc2)cc1-c1ccccc1.
What is the InChIKey of 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile?
The InChIKey is ROADTBZWOGHTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2/c1-14-13-21-19(17-9-7-15(12-20)8-10-17)11-18(14)16-5-3-2-4-6-16/h2-11,13H,1H3.
What are the key properties of 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile?
4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile has a molecular weight of 270.34 g/mol, XLogP of 4.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile is sourced from PubChem (CID 168821635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).