6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile

C30H19N3 — CID 146542957

IUPAC6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccccc32)nc1
InChIInChI=1S/C30H19N3/c31-19-21-17-18-27(32-20-21)23-10-2-1-9-22(23)24-11-3-6-14-28(24)33-29-15-7-4-12-25(29)26-13-5-8-16-30(26)33/h1-18,20H
InChIKeyQAZJDFVGSOXQKH-UHFFFAOYSA-N
MW421.50 g/mol
LogP7.38
Rot. Bonds3

About 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile

6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile (PubChem CID 146542957) has the molecular formula C30H19N3 and a molecular weight of 421.50 g/mol. Its IUPAC name is 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile
PubChem CID146542957
Molecular FormulaC30H19N3
Molecular Weight421.50 g/mol
Exact Mass421.16
IUPAC Name6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccccc32)nc1
InChIInChI=1S/C30H19N3/c31-19-21-17-18-27(32-20-21)23-10-2-1-9-22(23)24-11-3-6-14-28(24)33-29-15-7-4-12-25(29)26-13-5-8-16-30(26)33/h1-18,20H
InChIKeyQAZJDFVGSOXQKH-UHFFFAOYSA-N
XLogP7.38
TPSA41.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.50
LogP ≤ 57.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile?
The IUPAC name of 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile (CID 146542957) is 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile?
The canonical SMILES for 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile is N#Cc1ccc(-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccccc32)nc1.
What is the InChIKey of 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile?
The InChIKey is QAZJDFVGSOXQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19N3/c31-19-21-17-18-27(32-20-21)23-10-2-1-9-22(23)24-11-3-6-14-28(24)33-29-15-7-4-12-25(29)26-13-5-8-16-30(26)33/h1-18,20H.
What are the key properties of 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile?
6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile has a molecular weight of 421.50 g/mol, XLogP of 7.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-carbazol-9-ylphenyl)phenyl]pyridine-3-carbonitrile is sourced from PubChem (CID 146542957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).