3-methoxy-9H-carbazole

C13H11NO — CID 519621

IUPAC3-methoxy-9H-carbazole
SMILESCOc1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C13H11NO/c1-15-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8,14H,1H3
InChIKeyBISIQSCKDZYPLR-UHFFFAOYSA-N
MW197.24 g/mol
LogP3.33
Rot. Bonds1

About 3-methoxy-9H-carbazole

3-methoxy-9H-carbazole (PubChem CID 519621) has the molecular formula C13H11NO and a molecular weight of 197.24 g/mol. Its IUPAC name is 3-methoxy-9H-carbazole.

Molecular Properties

Compound Name3-methoxy-9H-carbazole
PubChem CID519621
Molecular FormulaC13H11NO
Molecular Weight197.24 g/mol
Exact Mass197.08
IUPAC Name3-methoxy-9H-carbazole
SMILESCOc1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C13H11NO/c1-15-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8,14H,1H3
InChIKeyBISIQSCKDZYPLR-UHFFFAOYSA-N
XLogP3.33
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-9H-carbazole?
The IUPAC name of 3-methoxy-9H-carbazole (CID 519621) is 3-methoxy-9H-carbazole.
What is the SMILES notation for 3-methoxy-9H-carbazole?
The canonical SMILES for 3-methoxy-9H-carbazole is COc1ccc2[nH]c3ccccc3c2c1.
What is the InChIKey of 3-methoxy-9H-carbazole?
The InChIKey is BISIQSCKDZYPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO/c1-15-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8,14H,1H3.
What are the key properties of 3-methoxy-9H-carbazole?
3-methoxy-9H-carbazole has a molecular weight of 197.24 g/mol, XLogP of 3.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-9H-carbazole is sourced from PubChem (CID 519621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).