2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile

C24H16ClN3 — CID 139222472

IUPAC2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2cccc(-c3ccc(Cl)cc3)c2)cc(-c2ccccc2)nc1N
InChIInChI=1S/C24H16ClN3/c25-20-11-9-16(10-12-20)18-7-4-8-19(13-18)21-14-23(17-5-2-1-3-6-17)28-24(27)22(21)15-26/h1-14H,(H2,27,28)
InChIKeyFFDQDTYKSSIOOQ-UHFFFAOYSA-N
MW381.87 g/mol
LogP6.19
Rot. Bonds3

About 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile

2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile (PubChem CID 139222472) has the molecular formula C24H16ClN3 and a molecular weight of 381.87 g/mol. Its IUPAC name is 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile
PubChem CID139222472
Molecular FormulaC24H16ClN3
Molecular Weight381.87 g/mol
Exact Mass381.10
IUPAC Name2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2cccc(-c3ccc(Cl)cc3)c2)cc(-c2ccccc2)nc1N
InChIInChI=1S/C24H16ClN3/c25-20-11-9-16(10-12-20)18-7-4-8-19(13-18)21-14-23(17-5-2-1-3-6-17)28-24(27)22(21)15-26/h1-14H,(H2,27,28)
InChIKeyFFDQDTYKSSIOOQ-UHFFFAOYSA-N
XLogP6.19
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.87
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(2,4-dichlorophenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 4659437
2-amino-4-(3-chlorophenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile
CID 3825642
2-amino-4-(3-methoxyphenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 5231001
2-amino-4-(3-chlorophenyl)-6-(4-nitrophenyl)pyridine-3-carbonitrile
CID 5258575
2-amino-4-(3-chlorophenyl)-6-pyridin-4-ylpyridine-3-carbonitrile
CID 4636492
2-amino-4-(4-chloro-3-nitrophenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 4659440
2-amino-4-(4-tert-butylphenyl)-6-phenylpyridine-3-carbonitrile
CID 3350002
2-amino-4-[4-(dimethylamino)phenyl]-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 4659292
2-amino-6-(2-fluorophenyl)-4-(4-phenylphenyl)pyridine-3-carbonitrile
CID 5119728
2-amino-4-(3-bromo-4-methoxyphenyl)-6-(4-chlorophenyl)pyridine-3-carbonitrile
CID 3379851
2-amino-6-(3,4-dichlorophenyl)-4-(3,4-difluorophenyl)pyridine-3-carbonitrile
CID 3529546
2-amino-4-(4-chlorophenyl)-6-thiophen-3-ylpyridine-3-carbonitrile
CID 44817568

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile (CID 139222472) is 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile is N#Cc1c(-c2cccc(-c3ccc(Cl)cc3)c2)cc(-c2ccccc2)nc1N.
What is the InChIKey of 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile?
The InChIKey is FFDQDTYKSSIOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16ClN3/c25-20-11-9-16(10-12-20)18-7-4-8-19(13-18)21-14-23(17-5-2-1-3-6-17)28-24(27)22(21)15-26/h1-14H,(H2,27,28).
What are the key properties of 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile?
2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile has a molecular weight of 381.87 g/mol, XLogP of 6.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-[3-(4-chlorophenyl)phenyl]-6-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 139222472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).