2,3-dihydropyrano[3,2-e]indole

C11H9NO — CID 54302224

IUPAC2,3-dihydropyrano[3,2-e]indole
SMILESC1=COc2ccc3c(c2=C1)=CCN3
InChIInChI=1S/C11H9NO/c1-2-9-8-5-6-12-10(8)3-4-11(9)13-7-1/h1-5,7,12H,6H2
InChIKeySFAQTGXDXGMPOT-UHFFFAOYSA-N
MW171.20 g/mol
LogP0.58
Rot. Bonds

About 2,3-dihydropyrano[3,2-e]indole

2,3-dihydropyrano[3,2-e]indole (PubChem CID 54302224) has the molecular formula C11H9NO and a molecular weight of 171.20 g/mol. Its IUPAC name is 2,3-dihydropyrano[3,2-e]indole.

Molecular Properties

Compound Name2,3-dihydropyrano[3,2-e]indole
PubChem CID54302224
Molecular FormulaC11H9NO
Molecular Weight171.20 g/mol
Exact Mass171.07
IUPAC Name2,3-dihydropyrano[3,2-e]indole
SMILESC1=COc2ccc3c(c2=C1)=CCN3
InChIInChI=1S/C11H9NO/c1-2-9-8-5-6-12-10(8)3-4-11(9)13-7-1/h1-5,7,12H,6H2
InChIKeySFAQTGXDXGMPOT-UHFFFAOYSA-N
XLogP0.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydropyrano[3,2-e]indole?
The IUPAC name of 2,3-dihydropyrano[3,2-e]indole (CID 54302224) is 2,3-dihydropyrano[3,2-e]indole.
What is the SMILES notation for 2,3-dihydropyrano[3,2-e]indole?
The canonical SMILES for 2,3-dihydropyrano[3,2-e]indole is C1=COc2ccc3c(c2=C1)=CCN3.
What is the InChIKey of 2,3-dihydropyrano[3,2-e]indole?
The InChIKey is SFAQTGXDXGMPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO/c1-2-9-8-5-6-12-10(8)3-4-11(9)13-7-1/h1-5,7,12H,6H2.
What are the key properties of 2,3-dihydropyrano[3,2-e]indole?
2,3-dihydropyrano[3,2-e]indole has a molecular weight of 171.20 g/mol, XLogP of 0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydropyrano[3,2-e]indole is sourced from PubChem (CID 54302224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).