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

C14H17NO — CID 65332833

IUPAC6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol
SMILESCc1cc(C)c2[nH]c3c(c2c1)C(O)CCC3
InChIInChI=1S/C14H17NO/c1-8-6-9(2)14-10(7-8)13-11(15-14)4-3-5-12(13)16/h6-7,12,15-16H,3-5H2,1-2H3
InChIKeyFAPVBJBQNPNVAK-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.15
Rot. Bonds

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

6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol (PubChem CID 65332833) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol.

Molecular Properties

Compound Name6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol
PubChem CID65332833
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol
SMILESCc1cc(C)c2[nH]c3c(c2c1)C(O)CCC3
InChIInChI=1S/C14H17NO/c1-8-6-9(2)14-10(7-8)13-11(15-14)4-3-5-12(13)16/h6-7,12,15-16H,3-5H2,1-2H3
InChIKeyFAPVBJBQNPNVAK-UHFFFAOYSA-N
XLogP3.15
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.15
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 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol?
The IUPAC name of 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol (CID 65332833) is 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol.
What is the SMILES notation for 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol?
The canonical SMILES for 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol is Cc1cc(C)c2[nH]c3c(c2c1)C(O)CCC3.
What is the InChIKey of 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol?
The InChIKey is FAPVBJBQNPNVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-8-6-9(2)14-10(7-8)13-11(15-14)4-3-5-12(13)16/h6-7,12,15-16H,3-5H2,1-2H3.
What are the key properties of 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol?
6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol has a molecular weight of 215.30 g/mol, XLogP of 3.15, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-ol is sourced from PubChem (CID 65332833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).