9H-carbazole-1,5-dicarbonitrile

C14H7N3 — CID 134477332

IUPAC9H-carbazole-1,5-dicarbonitrile
SMILESN#Cc1cccc2c1[nH]c1cccc(C#N)c12
InChIInChI=1S/C14H7N3/c15-7-9-3-2-6-12-13(9)11-5-1-4-10(8-16)14(11)17-12/h1-6,17H
InChIKeyAKBDFXXJSYSYSH-UHFFFAOYSA-N
MW217.23 g/mol
LogP3.06
Rot. Bonds

About 9H-carbazole-1,5-dicarbonitrile

9H-carbazole-1,5-dicarbonitrile (PubChem CID 134477332) has the molecular formula C14H7N3 and a molecular weight of 217.23 g/mol. Its IUPAC name is 9H-carbazole-1,5-dicarbonitrile.

Molecular Properties

Compound Name9H-carbazole-1,5-dicarbonitrile
PubChem CID134477332
Molecular FormulaC14H7N3
Molecular Weight217.23 g/mol
Exact Mass217.06
IUPAC Name9H-carbazole-1,5-dicarbonitrile
SMILESN#Cc1cccc2c1[nH]c1cccc(C#N)c12
InChIInChI=1S/C14H7N3/c15-7-9-3-2-6-12-13(9)11-5-1-4-10(8-16)14(11)17-12/h1-6,17H
InChIKeyAKBDFXXJSYSYSH-UHFFFAOYSA-N
XLogP3.06
TPSA63.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9H-carbazole-1,5-dicarbonitrile?
The IUPAC name of 9H-carbazole-1,5-dicarbonitrile (CID 134477332) is 9H-carbazole-1,5-dicarbonitrile.
What is the SMILES notation for 9H-carbazole-1,5-dicarbonitrile?
The canonical SMILES for 9H-carbazole-1,5-dicarbonitrile is N#Cc1cccc2c1[nH]c1cccc(C#N)c12.
What is the InChIKey of 9H-carbazole-1,5-dicarbonitrile?
The InChIKey is AKBDFXXJSYSYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7N3/c15-7-9-3-2-6-12-13(9)11-5-1-4-10(8-16)14(11)17-12/h1-6,17H.
What are the key properties of 9H-carbazole-1,5-dicarbonitrile?
9H-carbazole-1,5-dicarbonitrile has a molecular weight of 217.23 g/mol, XLogP of 3.06, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole-1,5-dicarbonitrile is sourced from PubChem (CID 134477332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).