3-phenyl-9H-carbazole-1,2-dicarbonitrile

C20H11N3 — CID 142753371

IUPAC3-phenyl-9H-carbazole-1,2-dicarbonitrile
SMILESN#Cc1c(-c2ccccc2)cc2c([nH]c3ccccc32)c1C#N
InChIInChI=1S/C20H11N3/c21-11-17-15(13-6-2-1-3-7-13)10-16-14-8-4-5-9-19(14)23-20(16)18(17)12-22/h1-10,23H
InChIKeyGBSHOMAKKMIFTP-UHFFFAOYSA-N
MW293.33 g/mol
LogP4.73
Rot. Bonds1

About 3-phenyl-9H-carbazole-1,2-dicarbonitrile

3-phenyl-9H-carbazole-1,2-dicarbonitrile (PubChem CID 142753371) has the molecular formula C20H11N3 and a molecular weight of 293.33 g/mol. Its IUPAC name is 3-phenyl-9H-carbazole-1,2-dicarbonitrile.

Molecular Properties

Compound Name3-phenyl-9H-carbazole-1,2-dicarbonitrile
PubChem CID142753371
Molecular FormulaC20H11N3
Molecular Weight293.33 g/mol
Exact Mass293.10
IUPAC Name3-phenyl-9H-carbazole-1,2-dicarbonitrile
SMILESN#Cc1c(-c2ccccc2)cc2c([nH]c3ccccc32)c1C#N
InChIInChI=1S/C20H11N3/c21-11-17-15(13-6-2-1-3-7-13)10-16-14-8-4-5-9-19(14)23-20(16)18(17)12-22/h1-10,23H
InChIKeyGBSHOMAKKMIFTP-UHFFFAOYSA-N
XLogP4.73
TPSA63.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-3-(1-phenyl-9H-carbazol-3-yl)-9H-carbazole
CID 175910913
11,12-dihydroindolo[2,3-a]carbazole-5,6-dicarbonitrile
CID 131849022
3,6-diphenylbenzene-1,2-dicarbonitrile
CID 10945840
8-bromo-5-phenyl-11H-benzo[a]carbazole
CID 176551555
2-phenyl-9H-carbazol-1-ol
CID 118682381
6-phenyl-5H-benzo[b]carbazole
CID 10756140
(2-phenyl-9H-carbazol-1-yl)boronic acid
CID 90240271
1-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
N,N-diphenyl-2-[3-phenyl-1-[2-(N-phenylanilino)phenyl]-9H-carbazol-2-yl]aniline
CID 166133960
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-9H-carbazole
CID 155673306
5-chloro-2-phenyl-1H-indole-3-carbonitrile
CID 22083583

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-9H-carbazole-1,2-dicarbonitrile?
The IUPAC name of 3-phenyl-9H-carbazole-1,2-dicarbonitrile (CID 142753371) is 3-phenyl-9H-carbazole-1,2-dicarbonitrile.
What is the SMILES notation for 3-phenyl-9H-carbazole-1,2-dicarbonitrile?
The canonical SMILES for 3-phenyl-9H-carbazole-1,2-dicarbonitrile is N#Cc1c(-c2ccccc2)cc2c([nH]c3ccccc32)c1C#N.
What is the InChIKey of 3-phenyl-9H-carbazole-1,2-dicarbonitrile?
The InChIKey is GBSHOMAKKMIFTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11N3/c21-11-17-15(13-6-2-1-3-7-13)10-16-14-8-4-5-9-19(14)23-20(16)18(17)12-22/h1-10,23H.
What are the key properties of 3-phenyl-9H-carbazole-1,2-dicarbonitrile?
3-phenyl-9H-carbazole-1,2-dicarbonitrile has a molecular weight of 293.33 g/mol, XLogP of 4.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-9H-carbazole-1,2-dicarbonitrile is sourced from PubChem (CID 142753371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).