2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile

C19H12ClF2N3 — CID 3317750

IUPAC2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile
SMILESCc1c(-c2ccc(Cl)cc2)nc(N)c(C#N)c1-c1cc(F)ccc1F
InChIInChI=1S/C19H12ClF2N3/c1-10-17(14-8-13(21)6-7-16(14)22)15(9-23)19(24)25-18(10)11-2-4-12(20)5-3-11/h2-8H,1H3,(H2,24,25)
InChIKeyAWFNLECPHWWVKM-UHFFFAOYSA-N
MW355.78 g/mol
LogP5.11
Rot. Bonds2

About 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile

2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile (PubChem CID 3317750) has the molecular formula C19H12ClF2N3 and a molecular weight of 355.78 g/mol. Its IUPAC name is 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile
PubChem CID3317750
Molecular FormulaC19H12ClF2N3
Molecular Weight355.78 g/mol
Exact Mass355.07
IUPAC Name2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile
SMILESCc1c(-c2ccc(Cl)cc2)nc(N)c(C#N)c1-c1cc(F)ccc1F
InChIInChI=1S/C19H12ClF2N3/c1-10-17(14-8-13(21)6-7-16(14)22)15(9-23)19(24)25-18(10)11-2-4-12(20)5-3-11/h2-8H,1H3,(H2,24,25)
InChIKeyAWFNLECPHWWVKM-UHFFFAOYSA-N
XLogP5.11
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.78
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(2-fluorophenyl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile
CID 5172789
2-amino-6-(4-chlorophenyl)-5-methyl-4-(2-methylphenyl)pyridine-3-carbonitrile
CID 3313312
2-amino-4-(2,3-dichlorophenyl)-6-(4-fluorophenyl)-5-methylpyridine-3-carbonitrile
CID 5166897
2-amino-4-(5-bromo-2-fluorophenyl)-6-(3-chlorophenyl)-5-methylpyridine-3-carbonitrile
CID 3326018
2-amino-6-(4-chlorophenyl)-5-methyl-4-(4-propan-2-ylphenyl)pyridine-3-carbonitrile
CID 3313314
2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile
CID 5159717
2-amino-4-(2,4-dichlorophenyl)-6-(4-methoxyphenyl)-5-methylpyridine-3-carbonitrile
CID 3308725
2-amino-6-(4-fluorophenyl)-5-methyl-4-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 5157022
2-amino-4-(4-tert-butylphenyl)-6-(4-fluorophenyl)-5-methylpyridine-3-carbonitrile
CID 5159861
2-amino-4-(4-chlorophenyl)-6-(2,4-dichlorophenyl)-5-methylpyridine-3-carbonitrile
CID 3330133
2-amino-6-(4-bromophenyl)-4-(4-chloro-3-fluorophenyl)-5-methylpyridine-3-carbonitrile
CID 3346636
2-amino-6-(4-chlorophenyl)-5-methyl-4-(1-methylpyrrol-2-yl)pyridine-3-carbonitrile
CID 3319637

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile (CID 3317750) is 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile is Cc1c(-c2ccc(Cl)cc2)nc(N)c(C#N)c1-c1cc(F)ccc1F.
What is the InChIKey of 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile?
The InChIKey is AWFNLECPHWWVKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClF2N3/c1-10-17(14-8-13(21)6-7-16(14)22)15(9-23)19(24)25-18(10)11-2-4-12(20)5-3-11/h2-8H,1H3,(H2,24,25).
What are the key properties of 2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile?
2-amino-6-(4-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile has a molecular weight of 355.78 g/mol, XLogP of 5.11, 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-chlorophenyl)-4-(2,5-difluorophenyl)-5-methylpyridine-3-carbonitrile is sourced from PubChem (CID 3317750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).