9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol

C13H15NO — CID 10442813

IUPAC9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol
SMILESCn1c2c(c3cc(O)ccc31)CCCC2
InChIInChI=1S/C13H15NO/c1-14-12-5-3-2-4-10(12)11-8-9(15)6-7-13(11)14/h6-8,15H,2-5H2,1H3
InChIKeyJAPZQASHCWXUBG-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.76
Rot. Bonds

About 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol

9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol (PubChem CID 10442813) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol.

Molecular Properties

Compound Name9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol
PubChem CID10442813
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol
SMILESCn1c2c(c3cc(O)ccc31)CCCC2
InChIInChI=1S/C13H15NO/c1-14-12-5-3-2-4-10(12)11-8-9(15)6-7-13(11)14/h6-8,15H,2-5H2,1H3
InChIKeyJAPZQASHCWXUBG-UHFFFAOYSA-N
XLogP2.76
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 5202
CID 5202
CID 10257
CID 10257
CID 9061
CID 9061
CID 160436
CID 160436
CID 219050
CID 219050
CID 150885
CID 150885
CID 16054
CID 16054
CID 3565
CID 3565
CID 2107
CID 2107
CID 1574
CID 1574
CID 4048638
CID 4048638
CID 159959
CID 159959

Frequently Asked Questions

What is the IUPAC name of 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol?
The IUPAC name of 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol (CID 10442813) is 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol.
What is the SMILES notation for 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol?
The canonical SMILES for 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol is Cn1c2c(c3cc(O)ccc31)CCCC2.
What is the InChIKey of 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol?
The InChIKey is JAPZQASHCWXUBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-14-12-5-3-2-4-10(12)11-8-9(15)6-7-13(11)14/h6-8,15H,2-5H2,1H3.
What are the key properties of 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol?
9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol has a molecular weight of 201.27 g/mol, XLogP of 2.76, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-5,6,7,8-tetrahydrocarbazol-3-ol is sourced from PubChem (CID 10442813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).