2,3,4,9-tetrahydro-1H-carbazol-3-ol

C12H13NO — CID 11571928

IUPAC2,3,4,9-tetrahydro-1H-carbazol-3-ol
SMILESOC1CCc2[nH]c3ccccc3c2C1
InChIInChI=1S/C12H13NO/c14-8-5-6-12-10(7-8)9-3-1-2-4-11(9)13-12/h1-4,8,13-14H,5-7H2
InChIKeyCOPGJLUCUMWXTH-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.02
Rot. Bonds

About 2,3,4,9-tetrahydro-1H-carbazol-3-ol

2,3,4,9-tetrahydro-1H-carbazol-3-ol (PubChem CID 11571928) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 2,3,4,9-tetrahydro-1H-carbazol-3-ol.

Molecular Properties

Compound Name2,3,4,9-tetrahydro-1H-carbazol-3-ol
PubChem CID11571928
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name2,3,4,9-tetrahydro-1H-carbazol-3-ol
SMILESOC1CCc2[nH]c3ccccc3c2C1
InChIInChI=1S/C12H13NO/c14-8-5-6-12-10(7-8)9-3-1-2-4-11(9)13-12/h1-4,8,13-14H,5-7H2
InChIKeyCOPGJLUCUMWXTH-UHFFFAOYSA-N
XLogP2.02
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,9-tetrahydro-1H-carbazol-3-ol?
The IUPAC name of 2,3,4,9-tetrahydro-1H-carbazol-3-ol (CID 11571928) is 2,3,4,9-tetrahydro-1H-carbazol-3-ol.
What is the SMILES notation for 2,3,4,9-tetrahydro-1H-carbazol-3-ol?
The canonical SMILES for 2,3,4,9-tetrahydro-1H-carbazol-3-ol is OC1CCc2[nH]c3ccccc3c2C1.
What is the InChIKey of 2,3,4,9-tetrahydro-1H-carbazol-3-ol?
The InChIKey is COPGJLUCUMWXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c14-8-5-6-12-10(7-8)9-3-1-2-4-11(9)13-12/h1-4,8,13-14H,5-7H2.
What are the key properties of 2,3,4,9-tetrahydro-1H-carbazol-3-ol?
2,3,4,9-tetrahydro-1H-carbazol-3-ol has a molecular weight of 187.24 g/mol, XLogP of 2.02, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,9-tetrahydro-1H-carbazol-3-ol is sourced from PubChem (CID 11571928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).