2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile

C20H16FN3 — CID 5159717

IUPAC2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile
SMILESCc1cccc(-c2c(C)c(-c3ccc(F)cc3)nc(N)c2C#N)c1
InChIInChI=1S/C20H16FN3/c1-12-4-3-5-15(10-12)18-13(2)19(24-20(23)17(18)11-22)14-6-8-16(21)9-7-14/h3-10H,1-2H3,(H2,23,24)
InChIKeyISRBMQPJSYUHSN-UHFFFAOYSA-N
MW317.37 g/mol
LogP4.63
Rot. Bonds2

About 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile

2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile (PubChem CID 5159717) has the molecular formula C20H16FN3 and a molecular weight of 317.37 g/mol. Its IUPAC name is 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile
PubChem CID5159717
Molecular FormulaC20H16FN3
Molecular Weight317.37 g/mol
Exact Mass317.13
IUPAC Name2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile
SMILESCc1cccc(-c2c(C)c(-c3ccc(F)cc3)nc(N)c2C#N)c1
InChIInChI=1S/C20H16FN3/c1-12-4-3-5-15(10-12)18-13(2)19(24-20(23)17(18)11-22)14-6-8-16(21)9-7-14/h3-10H,1-2H3,(H2,23,24)
InChIKeyISRBMQPJSYUHSN-UHFFFAOYSA-N
XLogP4.63
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(4-tert-butylphenyl)-6-(4-fluorophenyl)-5-methylpyridine-3-carbonitrile
CID 5159861
2-amino-4-(2,3-dichlorophenyl)-6-(4-fluorophenyl)-5-methylpyridine-3-carbonitrile
CID 5166897
2-amino-6-(3-chlorophenyl)-5-methyl-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 3324008
2-amino-4-(3-bromo-4-fluorophenyl)-6-(3-chlorophenyl)-5-methylpyridine-3-carbonitrile
CID 3326017
2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile
CID 3317750
2-amino-6-(4-fluorophenyl)-5-methyl-4-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 5157022
2-amino-4-(2-fluorophenyl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile
CID 5172789
2-amino-6-(4-bromophenyl)-4-(4-chloro-3-fluorophenyl)-5-methylpyridine-3-carbonitrile
CID 3346636
2-amino-4-(4-fluorophenyl)-5,6-dimethylpyridine-3-carbonitrile
CID 932580
2-amino-6-(3-chlorophenyl)-5-methyl-4-(2,3,4,5,6-pentafluorophenyl)pyridine-3-carbonitrile
CID 3324150
2-amino-4-(4-bromophenyl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile
CID 5172784
2-amino-5-methyl-6-(4-methylphenyl)-4-(3-phenylmethoxyphenyl)pyridine-3-carbonitrile
CID 5179024

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile (CID 5159717) is 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile is Cc1cccc(-c2c(C)c(-c3ccc(F)cc3)nc(N)c2C#N)c1.
What is the InChIKey of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile?
The InChIKey is ISRBMQPJSYUHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3/c1-12-4-3-5-15(10-12)18-13(2)19(24-20(23)17(18)11-22)14-6-8-16(21)9-7-14/h3-10H,1-2H3,(H2,23,24).
What are the key properties of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile?
2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile has a molecular weight of 317.37 g/mol, XLogP of 4.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 5159717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).