5-methyl-4bH-indeno[1,2-b]indol-10-ol

C16H13NO — CID 71718245

IUPAC5-methyl-4bH-indeno[1,2-b]indol-10-ol
SMILESCN1c2ccccc2C2=C(O)c3ccccc3C21
InChIInChI=1S/C16H13NO/c1-17-13-9-5-4-8-12(13)14-15(17)10-6-2-3-7-11(10)16(14)18/h2-9,15,18H,1H3
InChIKeyJLZAODCBOKWOGQ-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.62
Rot. Bonds

About 5-methyl-4bH-indeno[1,2-b]indol-10-ol

5-methyl-4bH-indeno[1,2-b]indol-10-ol (PubChem CID 71718245) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 5-methyl-4bH-indeno[1,2-b]indol-10-ol.

Molecular Properties

Compound Name5-methyl-4bH-indeno[1,2-b]indol-10-ol
PubChem CID71718245
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name5-methyl-4bH-indeno[1,2-b]indol-10-ol
SMILESCN1c2ccccc2C2=C(O)c3ccccc3C21
InChIInChI=1S/C16H13NO/c1-17-13-9-5-4-8-12(13)14-15(17)10-6-2-3-7-11(10)16(14)18/h2-9,15,18H,1H3
InChIKeyJLZAODCBOKWOGQ-UHFFFAOYSA-N
XLogP3.62
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-4bH-indeno[1,2-b]indol-10-ol?
The IUPAC name of 5-methyl-4bH-indeno[1,2-b]indol-10-ol (CID 71718245) is 5-methyl-4bH-indeno[1,2-b]indol-10-ol.
What is the SMILES notation for 5-methyl-4bH-indeno[1,2-b]indol-10-ol?
The canonical SMILES for 5-methyl-4bH-indeno[1,2-b]indol-10-ol is CN1c2ccccc2C2=C(O)c3ccccc3C21.
What is the InChIKey of 5-methyl-4bH-indeno[1,2-b]indol-10-ol?
The InChIKey is JLZAODCBOKWOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-17-13-9-5-4-8-12(13)14-15(17)10-6-2-3-7-11(10)16(14)18/h2-9,15,18H,1H3.
What are the key properties of 5-methyl-4bH-indeno[1,2-b]indol-10-ol?
5-methyl-4bH-indeno[1,2-b]indol-10-ol has a molecular weight of 235.29 g/mol, XLogP of 3.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4bH-indeno[1,2-b]indol-10-ol is sourced from PubChem (CID 71718245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).