6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol

C13H14FNO — CID 65332564

IUPAC6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol
SMILESCc1cc(F)cc2c3c([nH]c12)CCC(O)C3
InChIInChI=1S/C13H14FNO/c1-7-4-8(14)5-11-10-6-9(16)2-3-12(10)15-13(7)11/h4-5,9,15-16H,2-3,6H2,1H3
InChIKeyLVHOAIRLKIZXED-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.47
Rot. Bonds

About 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol

6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol (PubChem CID 65332564) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol.

Molecular Properties

Compound Name6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol
PubChem CID65332564
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC Name6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol
SMILESCc1cc(F)cc2c3c([nH]c12)CCC(O)C3
InChIInChI=1S/C13H14FNO/c1-7-4-8(14)5-11-10-6-9(16)2-3-12(10)15-13(7)11/h4-5,9,15-16H,2-3,6H2,1H3
InChIKeyLVHOAIRLKIZXED-UHFFFAOYSA-N
XLogP2.47
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.47
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 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol?
The IUPAC name of 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol (CID 65332564) is 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol.
What is the SMILES notation for 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol?
The canonical SMILES for 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol is Cc1cc(F)cc2c3c([nH]c12)CCC(O)C3.
What is the InChIKey of 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol?
The InChIKey is LVHOAIRLKIZXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c1-7-4-8(14)5-11-10-6-9(16)2-3-12(10)15-13(7)11/h4-5,9,15-16H,2-3,6H2,1H3.
What are the key properties of 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol?
6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol has a molecular weight of 219.26 g/mol, XLogP of 2.47, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-8-methyl-2,3,4,9-tetrahydro-1H-carbazol-3-ol is sourced from PubChem (CID 65332564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).