2H-pyrano[2,3-e]indol-8-one

C11H7NO2 — CID 140976849

IUPAC2H-pyrano[2,3-e]indol-8-one
SMILESO=C1C=c2c3c(ccc2=N1)C=CCO3
InChIInChI=1S/C11H7NO2/c13-10-6-8-9(12-10)4-3-7-2-1-5-14-11(7)8/h1-4,6H,5H2
InChIKeyPSEUQLMVHMUNDH-UHFFFAOYSA-N
MW185.18 g/mol
LogP0.03
Rot. Bonds

About 2H-pyrano[2,3-e]indol-8-one

2H-pyrano[2,3-e]indol-8-one (PubChem CID 140976849) has the molecular formula C11H7NO2 and a molecular weight of 185.18 g/mol. Its IUPAC name is 2H-pyrano[2,3-e]indol-8-one.

Molecular Properties

Compound Name2H-pyrano[2,3-e]indol-8-one
PubChem CID140976849
Molecular FormulaC11H7NO2
Molecular Weight185.18 g/mol
Exact Mass185.05
IUPAC Name2H-pyrano[2,3-e]indol-8-one
SMILESO=C1C=c2c3c(ccc2=N1)C=CCO3
InChIInChI=1S/C11H7NO2/c13-10-6-8-9(12-10)4-3-7-2-1-5-14-11(7)8/h1-4,6H,5H2
InChIKeyPSEUQLMVHMUNDH-UHFFFAOYSA-N
XLogP0.03
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2H-pyrano[2,3-e]indol-8-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2H-pyrano[2,3-e]indol-8-one?
The IUPAC name of 2H-pyrano[2,3-e]indol-8-one (CID 140976849) is 2H-pyrano[2,3-e]indol-8-one.
What is the SMILES notation for 2H-pyrano[2,3-e]indol-8-one?
The canonical SMILES for 2H-pyrano[2,3-e]indol-8-one is O=C1C=c2c3c(ccc2=N1)C=CCO3.
What is the InChIKey of 2H-pyrano[2,3-e]indol-8-one?
The InChIKey is PSEUQLMVHMUNDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NO2/c13-10-6-8-9(12-10)4-3-7-2-1-5-14-11(7)8/h1-4,6H,5H2.
What are the key properties of 2H-pyrano[2,3-e]indol-8-one?
2H-pyrano[2,3-e]indol-8-one has a molecular weight of 185.18 g/mol, XLogP of 0.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyrano[2,3-e]indol-8-one is sourced from PubChem (CID 140976849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).