6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile

C24H15FN4 — CID 102222806

IUPAC6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile
SMILESN#Cc1cc(/N=N/c2ccccc2)c(-c2ccc(F)cc2)nc1-c1ccccc1
InChIInChI=1S/C24H15FN4/c25-20-13-11-18(12-14-20)24-22(29-28-21-9-5-2-6-10-21)15-19(16-26)23(27-24)17-7-3-1-4-8-17/h1-15H/b29-28+
InChIKeyWUJQCFWFHPTVAO-ZQHSETAFSA-N
MW378.41 g/mol
LogP6.84
Rot. Bonds4

About 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile

6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile (PubChem CID 102222806) has the molecular formula C24H15FN4 and a molecular weight of 378.41 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile
PubChem CID102222806
Molecular FormulaC24H15FN4
Molecular Weight378.41 g/mol
Exact Mass378.13
IUPAC Name6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile
SMILESN#Cc1cc(/N=N/c2ccccc2)c(-c2ccc(F)cc2)nc1-c1ccccc1
InChIInChI=1S/C24H15FN4/c25-20-13-11-18(12-14-20)24-22(29-28-21-9-5-2-6-10-21)15-19(16-26)23(27-24)17-7-3-1-4-8-17/h1-15H/b29-28+
InChIKeyWUJQCFWFHPTVAO-ZQHSETAFSA-N
XLogP6.84
TPSA61.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.41
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

CID 74311
CID 74311
CID 275938
CID 275938
CID 56604871
CID 56604871
CID 56851824
CID 56851824
CID 13007266
CID 13007266
CID 299949
CID 299949
CID 2260050
CID 2260050
CID 3700648
CID 3700648
CID 921490
CID 921490
CID 11391493
CID 11391493
CID 629756
CID 629756
CID 71729474
CID 71729474

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile?
The IUPAC name of 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile (CID 102222806) is 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile.
What is the SMILES notation for 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile?
The canonical SMILES for 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile is N#Cc1cc(/N=N/c2ccccc2)c(-c2ccc(F)cc2)nc1-c1ccccc1.
What is the InChIKey of 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile?
The InChIKey is WUJQCFWFHPTVAO-ZQHSETAFSA-N. The full InChI is InChI=1S/C24H15FN4/c25-20-13-11-18(12-14-20)24-22(29-28-21-9-5-2-6-10-21)15-19(16-26)23(27-24)17-7-3-1-4-8-17/h1-15H/b29-28+.
What are the key properties of 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile?
6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile has a molecular weight of 378.41 g/mol, XLogP of 6.84, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-2-phenyl-5-phenyldiazenylpyridine-3-carbonitrile is sourced from PubChem (CID 102222806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).