6-methyl-9-phenylcarbazole-2-carbonitrile

C20H14N2 — CID 129176191

IUPAC6-methyl-9-phenylcarbazole-2-carbonitrile
SMILESCc1ccc2c(c1)c1ccc(C#N)cc1n2-c1ccccc1
InChIInChI=1S/C20H14N2/c1-14-7-10-19-18(11-14)17-9-8-15(13-21)12-20(17)22(19)16-5-3-2-4-6-16/h2-12H,1H3
InChIKeyOZTCLXWJARCHOG-UHFFFAOYSA-N
MW282.35 g/mol
LogP4.96
Rot. Bonds1

About 6-methyl-9-phenylcarbazole-2-carbonitrile

6-methyl-9-phenylcarbazole-2-carbonitrile (PubChem CID 129176191) has the molecular formula C20H14N2 and a molecular weight of 282.35 g/mol. Its IUPAC name is 6-methyl-9-phenylcarbazole-2-carbonitrile.

Molecular Properties

Compound Name6-methyl-9-phenylcarbazole-2-carbonitrile
PubChem CID129176191
Molecular FormulaC20H14N2
Molecular Weight282.35 g/mol
Exact Mass282.12
IUPAC Name6-methyl-9-phenylcarbazole-2-carbonitrile
SMILESCc1ccc2c(c1)c1ccc(C#N)cc1n2-c1ccccc1
InChIInChI=1S/C20H14N2/c1-14-7-10-19-18(11-14)17-9-8-15(13-21)12-20(17)22(19)16-5-3-2-4-6-16/h2-12H,1H3
InChIKeyOZTCLXWJARCHOG-UHFFFAOYSA-N
XLogP4.96
TPSA28.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-9-phenylcarbazole-2-carbonitrile?
The IUPAC name of 6-methyl-9-phenylcarbazole-2-carbonitrile (CID 129176191) is 6-methyl-9-phenylcarbazole-2-carbonitrile.
What is the SMILES notation for 6-methyl-9-phenylcarbazole-2-carbonitrile?
The canonical SMILES for 6-methyl-9-phenylcarbazole-2-carbonitrile is Cc1ccc2c(c1)c1ccc(C#N)cc1n2-c1ccccc1.
What is the InChIKey of 6-methyl-9-phenylcarbazole-2-carbonitrile?
The InChIKey is OZTCLXWJARCHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2/c1-14-7-10-19-18(11-14)17-9-8-15(13-21)12-20(17)22(19)16-5-3-2-4-6-16/h2-12H,1H3.
What are the key properties of 6-methyl-9-phenylcarbazole-2-carbonitrile?
6-methyl-9-phenylcarbazole-2-carbonitrile has a molecular weight of 282.35 g/mol, XLogP of 4.96, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-9-phenylcarbazole-2-carbonitrile is sourced from PubChem (CID 129176191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).