9-ethylcarbazole-3-carboxylate

C15H12NO2- — CID 7148416

IUPAC9-ethylcarbazole-3-carboxylate
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)/p-1
InChIKeyQZQNANUJNRAGPZ-UHFFFAOYSA-M
MW238.27 g/mol
LogP2.18
Rot. Bonds2

About 9-ethylcarbazole-3-carboxylate

9-ethylcarbazole-3-carboxylate (PubChem CID 7148416) has the molecular formula C15H12NO2- and a molecular weight of 238.27 g/mol. Its IUPAC name is 9-ethylcarbazole-3-carboxylate.

Molecular Properties

Compound Name9-ethylcarbazole-3-carboxylate
PubChem CID7148416
Molecular FormulaC15H12NO2-
Molecular Weight238.27 g/mol
Exact Mass238.09
IUPAC Name9-ethylcarbazole-3-carboxylate
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)/p-1
InChIKeyQZQNANUJNRAGPZ-UHFFFAOYSA-M
XLogP2.18
TPSA45.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-ethylcarbazole-3-carboxylic acid
CID 4912869
9-ethyl-3-[(E)-2-(9-ethylcarbazol-3-yl)-1,2-diphenylethenyl]carbazole
CID 102220131
9-ethyl-N,N-dimethylcarbazole-3-carboxamide
CID 163964567
(9-ethylcarbazol-3-yl)-(2-ethylphenyl)methanone
CID 141364067
1-(6-acetyl-9-ethylcarbazol-3-yl)ethanone
CID 622083
[3,5-bis(trifluoromethyl)phenyl]-(9-ethylcarbazol-3-yl)methanone
CID 155432714
[4-[bis(9-ethylcarbazol-3-yl)amino]phenyl]-phenylmethanone
CID 177399395
acetic acid;9-ethylcarbazol-3-amine
CID 68649355
(9-ethylcarbazol-3-yl)-trimethylstannane
CID 71421811
1-(9-propylcarbazol-3-yl)butan-1-one
CID 145412526
9-propylcarbazole-3-carbonyl iodide
CID 88957757
(6-deuterio-9-ethylcarbazol-3-yl)-(2-methylphenyl)methanone
CID 175814606

Frequently Asked Questions

What is the IUPAC name of 9-ethylcarbazole-3-carboxylate?
The IUPAC name of 9-ethylcarbazole-3-carboxylate (CID 7148416) is 9-ethylcarbazole-3-carboxylate.
What is the SMILES notation for 9-ethylcarbazole-3-carboxylate?
The canonical SMILES for 9-ethylcarbazole-3-carboxylate is CCn1c2ccccc2c2cc(C(=O)[O-])ccc21.
What is the InChIKey of 9-ethylcarbazole-3-carboxylate?
The InChIKey is QZQNANUJNRAGPZ-UHFFFAOYSA-M. 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)/p-1.
What are the key properties of 9-ethylcarbazole-3-carboxylate?
9-ethylcarbazole-3-carboxylate has a molecular weight of 238.27 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethylcarbazole-3-carboxylate is sourced from PubChem (CID 7148416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).