3,10-dihydropyrano[2,3-c]indol-7-one

C11H9NO2 — CID 69190633

IUPAC3,10-dihydropyrano[2,3-c]indol-7-one
SMILESO=C1C=CCC23C=CCOC2=CN=C13
InChIInChI=1S/C11H9NO2/c13-8-3-1-4-11-5-2-6-14-9(11)7-12-10(8)11/h1-3,5,7H,4,6H2
InChIKeySTMYYWCADATDPH-UHFFFAOYSA-N
MW187.20 g/mol
LogP1.38
Rot. Bonds

About 3,10-dihydropyrano[2,3-c]indol-7-one

3,10-dihydropyrano[2,3-c]indol-7-one (PubChem CID 69190633) has the molecular formula C11H9NO2 and a molecular weight of 187.20 g/mol. Its IUPAC name is 3,10-dihydropyrano[2,3-c]indol-7-one.

Molecular Properties

Compound Name3,10-dihydropyrano[2,3-c]indol-7-one
PubChem CID69190633
Molecular FormulaC11H9NO2
Molecular Weight187.20 g/mol
Exact Mass187.06
IUPAC Name3,10-dihydropyrano[2,3-c]indol-7-one
SMILESO=C1C=CCC23C=CCOC2=CN=C13
InChIInChI=1S/C11H9NO2/c13-8-3-1-4-11-5-2-6-14-9(11)7-12-10(8)11/h1-3,5,7H,4,6H2
InChIKeySTMYYWCADATDPH-UHFFFAOYSA-N
XLogP1.38
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,10-dihydropyrano[2,3-c]indol-7-one?
The IUPAC name of 3,10-dihydropyrano[2,3-c]indol-7-one (CID 69190633) is 3,10-dihydropyrano[2,3-c]indol-7-one.
What is the SMILES notation for 3,10-dihydropyrano[2,3-c]indol-7-one?
The canonical SMILES for 3,10-dihydropyrano[2,3-c]indol-7-one is O=C1C=CCC23C=CCOC2=CN=C13.
What is the InChIKey of 3,10-dihydropyrano[2,3-c]indol-7-one?
The InChIKey is STMYYWCADATDPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO2/c13-8-3-1-4-11-5-2-6-14-9(11)7-12-10(8)11/h1-3,5,7H,4,6H2.
What are the key properties of 3,10-dihydropyrano[2,3-c]indol-7-one?
3,10-dihydropyrano[2,3-c]indol-7-one has a molecular weight of 187.20 g/mol, XLogP of 1.38, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,10-dihydropyrano[2,3-c]indol-7-one is sourced from PubChem (CID 69190633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).