6-methoxy-9H-carbazole-3-carboxylic acid

C14H11NO3 — CID 21087559

IUPAC6-methoxy-9H-carbazole-3-carboxylic acid
SMILESCOc1ccc2[nH]c3ccc(C(=O)O)cc3c2c1
InChIInChI=1S/C14H11NO3/c1-18-9-3-5-13-11(7-9)10-6-8(14(16)17)2-4-12(10)15-13/h2-7,15H,1H3,(H,16,17)
InChIKeyCFNPTGYSAAZIAE-UHFFFAOYSA-N
MW241.25 g/mol
LogP3.03
Rot. Bonds2

About 6-methoxy-9H-carbazole-3-carboxylic acid

6-methoxy-9H-carbazole-3-carboxylic acid (PubChem CID 21087559) has the molecular formula C14H11NO3 and a molecular weight of 241.25 g/mol. Its IUPAC name is 6-methoxy-9H-carbazole-3-carboxylic acid.

Molecular Properties

Compound Name6-methoxy-9H-carbazole-3-carboxylic acid
PubChem CID21087559
Molecular FormulaC14H11NO3
Molecular Weight241.25 g/mol
Exact Mass241.07
IUPAC Name6-methoxy-9H-carbazole-3-carboxylic acid
SMILESCOc1ccc2[nH]c3ccc(C(=O)O)cc3c2c1
InChIInChI=1S/C14H11NO3/c1-18-9-3-5-13-11(7-9)10-6-8(14(16)17)2-4-12(10)15-13/h2-7,15H,1H3,(H,16,17)
InChIKeyCFNPTGYSAAZIAE-UHFFFAOYSA-N
XLogP3.03
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-9H-carbazole-3-carboxylic acid?
The IUPAC name of 6-methoxy-9H-carbazole-3-carboxylic acid (CID 21087559) is 6-methoxy-9H-carbazole-3-carboxylic acid.
What is the SMILES notation for 6-methoxy-9H-carbazole-3-carboxylic acid?
The canonical SMILES for 6-methoxy-9H-carbazole-3-carboxylic acid is COc1ccc2[nH]c3ccc(C(=O)O)cc3c2c1.
What is the InChIKey of 6-methoxy-9H-carbazole-3-carboxylic acid?
The InChIKey is CFNPTGYSAAZIAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO3/c1-18-9-3-5-13-11(7-9)10-6-8(14(16)17)2-4-12(10)15-13/h2-7,15H,1H3,(H,16,17).
What are the key properties of 6-methoxy-9H-carbazole-3-carboxylic acid?
6-methoxy-9H-carbazole-3-carboxylic acid has a molecular weight of 241.25 g/mol, XLogP of 3.03, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-9H-carbazole-3-carboxylic acid is sourced from PubChem (CID 21087559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).