1-methyl-9H-carbazole

C13H11N — CID 23011

IUPAC1-methyl-9H-carbazole
SMILESCc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C13H11N/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8,14H,1H3
InChIKeyHIAGSPVAYSSKHL-UHFFFAOYSA-N
MW181.24 g/mol
LogP3.63
Rot. Bonds

About 1-methyl-9H-carbazole

1-methyl-9H-carbazole (PubChem CID 23011) has the molecular formula C13H11N and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-methyl-9H-carbazole.

Molecular Properties

Compound Name1-methyl-9H-carbazole
PubChem CID23011
Molecular FormulaC13H11N
Molecular Weight181.24 g/mol
Exact Mass181.09
IUPAC Name1-methyl-9H-carbazole
SMILESCc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C13H11N/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8,14H,1H3
InChIKeyHIAGSPVAYSSKHL-UHFFFAOYSA-N
XLogP3.63
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-9H-carbazole?
The IUPAC name of 1-methyl-9H-carbazole (CID 23011) is 1-methyl-9H-carbazole.
What is the SMILES notation for 1-methyl-9H-carbazole?
The canonical SMILES for 1-methyl-9H-carbazole is Cc1cccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-methyl-9H-carbazole?
The InChIKey is HIAGSPVAYSSKHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8,14H,1H3.
What are the key properties of 1-methyl-9H-carbazole?
1-methyl-9H-carbazole has a molecular weight of 181.24 g/mol, XLogP of 3.63, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-9H-carbazole is sourced from PubChem (CID 23011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).