9-ethylcarbazole-3-carboxylic acid

C15H13NO2 — CID 4912869

IUPAC9-ethylcarbazole-3-carboxylic acid
SMILESCCn1c2ccccc2c2cc(C(=O)O)ccc21
InChIInChI=1S/C15H13NO2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15(17)18)7-8-14(12)16/h3-9H,2H2,1H3,(H,17,18)
InChIKeyQZQNANUJNRAGPZ-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.51
Rot. Bonds2

About 9-ethylcarbazole-3-carboxylic acid

9-ethylcarbazole-3-carboxylic acid (PubChem CID 4912869) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 9-ethylcarbazole-3-carboxylic acid.

Molecular Properties

Compound Name9-ethylcarbazole-3-carboxylic acid
PubChem CID4912869
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name9-ethylcarbazole-3-carboxylic acid
SMILESCCn1c2ccccc2c2cc(C(=O)O)ccc21
InChIInChI=1S/C15H13NO2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15(17)18)7-8-14(12)16/h3-9H,2H2,1H3,(H,17,18)
InChIKeyQZQNANUJNRAGPZ-UHFFFAOYSA-N
XLogP3.51
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 9-ethylcarbazole-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-ethyl-3-[(E)-2-(9-ethylcarbazol-3-yl)-1,2-diphenylethenyl]carbazole
CID 102220131
9-ethylcarbazole-3-carboxylate
CID 7148416
9-ethyl-N,N-dimethylcarbazole-3-carboxamide
CID 163964567
9-ethyl-6-(3-oxobutanoyl)carbazole-3-carboxylic acid
CID 59331093
(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone
CID 141364067
[3,5-bis(trifluoromethyl)phenyl]-(9-ethylcarbazol-3-yl)methanone
CID 155432714
1-ethyl-2,3-dimethylindole-5-carboxylic acid
CID 608826
[4-[bis(9-ethylcarbazol-3-yl)amino]phenyl]-phenylmethanone
CID 177399395
acetic acid;9-ethylcarbazol-3-amine
CID 68649355
1-(6-acetyl-9-ethylcarbazol-3-yl)ethanone
CID 622083
9-[6-(3,6-dicarboxycarbazol-9-yl)hexyl]carbazole-3,6-dicarboxylic acid
CID 53342508
2-(9-ethylcarbazol-3-yl)-2-hydroxyacetic acid
CID 117426376

Frequently Asked Questions

What is the IUPAC name of 9-ethylcarbazole-3-carboxylic acid?
The IUPAC name of 9-ethylcarbazole-3-carboxylic acid (CID 4912869) is 9-ethylcarbazole-3-carboxylic acid.
What is the SMILES notation for 9-ethylcarbazole-3-carboxylic acid?
The canonical SMILES for 9-ethylcarbazole-3-carboxylic acid is CCn1c2ccccc2c2cc(C(=O)O)ccc21.
What is the InChIKey of 9-ethylcarbazole-3-carboxylic acid?
The InChIKey is QZQNANUJNRAGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15(17)18)7-8-14(12)16/h3-9H,2H2,1H3,(H,17,18).
What are the key properties of 9-ethylcarbazole-3-carboxylic acid?
9-ethylcarbazole-3-carboxylic acid has a molecular weight of 239.27 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethylcarbazole-3-carboxylic acid is sourced from PubChem (CID 4912869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).