ethyl carbazole-9-carboxylate

C15H13NO2 — CID 3746009

IUPACethyl carbazole-9-carboxylate
SMILESCCOC(=O)n1c2ccccc2c2ccccc21
InChIInChI=1S/C15H13NO2/c1-2-18-15(17)16-13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-10H,2H2,1H3
InChIKeyRQAYMOTWPNCISV-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.80
Rot. Bonds1

About ethyl carbazole-9-carboxylate

ethyl carbazole-9-carboxylate (PubChem CID 3746009) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is ethyl carbazole-9-carboxylate.

Molecular Properties

Compound Nameethyl carbazole-9-carboxylate
PubChem CID3746009
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Nameethyl carbazole-9-carboxylate
SMILESCCOC(=O)n1c2ccccc2c2ccccc21
InChIInChI=1S/C15H13NO2/c1-2-18-15(17)16-13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-10H,2H2,1H3
InChIKeyRQAYMOTWPNCISV-UHFFFAOYSA-N
XLogP3.80
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl carbazole-9-carboxylate?
The IUPAC name of ethyl carbazole-9-carboxylate (CID 3746009) is ethyl carbazole-9-carboxylate.
What is the SMILES notation for ethyl carbazole-9-carboxylate?
The canonical SMILES for ethyl carbazole-9-carboxylate is CCOC(=O)n1c2ccccc2c2ccccc21.
What is the InChIKey of ethyl carbazole-9-carboxylate?
The InChIKey is RQAYMOTWPNCISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-2-18-15(17)16-13-9-5-3-7-11(13)12-8-4-6-10-14(12)16/h3-10H,2H2,1H3.
What are the key properties of ethyl carbazole-9-carboxylate?
ethyl carbazole-9-carboxylate has a molecular weight of 239.27 g/mol, XLogP of 3.80, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl carbazole-9-carboxylate is sourced from PubChem (CID 3746009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).