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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Related Compounds

2-(9H-carbazol-4-yl)benzonitrile
CID 171060535
2-[12-(2-cyanophenyl)-5,11-dihydroindolo[3,2-b]carbazol-6-yl]benzonitrile
CID 155081196
4-hydroxy-9H-carbazole-1-carbonitrile
CID 86108678
2-formyl-3-methyl-1H-indole-7-carbonitrile
CID 105441052
2-oxo-3H-1,3-benzothiazole-7-carbonitrile
CID 84655526
11,12-dihydroindolo[2,3-a]carbazole-5,6-dicarbonitrile
CID 131849022
6-[(1S)-2-methylcyclopropyl]-9H-carbazole-1-carbonitrile
CID 163560085
3,4-dimethyl-9H-carbazole-1-carbonitrile
CID 101496372
3-(1-aminoethyl)-2-methyl-1H-indole-4-carbonitrile
CID 105452210
4-oxo-3,5-diazapentacyclo[9.7.1.12,6.015,19.010,20]icosa-1(18),2,6,8,10(20),11(19),12,14,16-nonaene-14-carbonitrile
CID 155815204
3-sulfanyl-1H-indole-4-carbonitrile
CID 155575103
3-amino-1H-indazole-4-carbonitrile
CID 54016394

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).