9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid

C19H19NO3 — CID 24992779

IUPAC9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid
SMILESO=C(O)c1ccc2c3ccccc3n(C3CCC(O)CC3)c2c1
InChIInChI=1S/C19H19NO3/c21-14-8-6-13(7-9-14)20-17-4-2-1-3-15(17)16-10-5-12(19(22)23)11-18(16)20/h1-5,10-11,13-14,21H,6-9H2,(H,22,23)
InChIKeyIQEDEEFNHKLTRK-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.97
Rot. Bonds2

About 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid

9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid (PubChem CID 24992779) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid.

Molecular Properties

Compound Name9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid
PubChem CID24992779
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC Name9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid
SMILESO=C(O)c1ccc2c3ccccc3n(C3CCC(O)CC3)c2c1
InChIInChI=1S/C19H19NO3/c21-14-8-6-13(7-9-14)20-17-4-2-1-3-15(17)16-10-5-12(19(22)23)11-18(16)20/h1-5,10-11,13-14,21H,6-9H2,(H,22,23)
InChIKeyIQEDEEFNHKLTRK-UHFFFAOYSA-N
XLogP3.97
TPSA62.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid?
The IUPAC name of 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid (CID 24992779) is 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid.
What is the SMILES notation for 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid?
The canonical SMILES for 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid is O=C(O)c1ccc2c3ccccc3n(C3CCC(O)CC3)c2c1.
What is the InChIKey of 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid?
The InChIKey is IQEDEEFNHKLTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c21-14-8-6-13(7-9-14)20-17-4-2-1-3-15(17)16-10-5-12(19(22)23)11-18(16)20/h1-5,10-11,13-14,21H,6-9H2,(H,22,23).
What are the key properties of 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid?
9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid has a molecular weight of 309.37 g/mol, XLogP of 3.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-hydroxycyclohexyl)carbazole-2-carboxylic acid is sourced from PubChem (CID 24992779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).