8H-carbazole-1-carbonitrile

C13H8N2 — CID 174862040

IUPAC8H-carbazole-1-carbonitrile
SMILESN#Cc1cccc2c1N=C1CC=CC=C12
InChIInChI=1S/C13H8N2/c14-8-9-4-3-6-11-10-5-1-2-7-12(10)15-13(9)11/h1-6H,7H2
InChIKeyBTXIPEKPKPFGRD-UHFFFAOYSA-N
MW192.22 g/mol
LogP2.99
Rot. Bonds

About 8H-carbazole-1-carbonitrile

8H-carbazole-1-carbonitrile (PubChem CID 174862040) has the molecular formula C13H8N2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 8H-carbazole-1-carbonitrile.

Molecular Properties

Compound Name8H-carbazole-1-carbonitrile
PubChem CID174862040
Molecular FormulaC13H8N2
Molecular Weight192.22 g/mol
Exact Mass192.07
IUPAC Name8H-carbazole-1-carbonitrile
SMILESN#Cc1cccc2c1N=C1CC=CC=C12
InChIInChI=1S/C13H8N2/c14-8-9-4-3-6-11-10-5-1-2-7-12(10)15-13(9)11/h1-6H,7H2
InChIKeyBTXIPEKPKPFGRD-UHFFFAOYSA-N
XLogP2.99
TPSA36.15 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8H-carbazole-1-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8H-carbazole-1-carbonitrile?
The IUPAC name of 8H-carbazole-1-carbonitrile (CID 174862040) is 8H-carbazole-1-carbonitrile.
What is the SMILES notation for 8H-carbazole-1-carbonitrile?
The canonical SMILES for 8H-carbazole-1-carbonitrile is N#Cc1cccc2c1N=C1CC=CC=C12.
What is the InChIKey of 8H-carbazole-1-carbonitrile?
The InChIKey is BTXIPEKPKPFGRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8N2/c14-8-9-4-3-6-11-10-5-1-2-7-12(10)15-13(9)11/h1-6H,7H2.
What are the key properties of 8H-carbazole-1-carbonitrile?
8H-carbazole-1-carbonitrile has a molecular weight of 192.22 g/mol, XLogP of 2.99, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8H-carbazole-1-carbonitrile is sourced from PubChem (CID 174862040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).