6-(azetidin-3-yloxy)-1H-indole

C11H12N2O — CID 84661437

IUPAC6-(azetidin-3-yloxy)-1H-indole
SMILESc1cc2ccc(OC3CNC3)cc2[nH]1
InChIInChI=1S/C11H12N2O/c1-2-9(14-10-6-12-7-10)5-11-8(1)3-4-13-11/h1-5,10,12-13H,6-7H2
InChIKeyRVPZDKPAVJWIIJ-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.52
Rot. Bonds2

About 6-(azetidin-3-yloxy)-1H-indole

6-(azetidin-3-yloxy)-1H-indole (PubChem CID 84661437) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 6-(azetidin-3-yloxy)-1H-indole.

Molecular Properties

Compound Name6-(azetidin-3-yloxy)-1H-indole
PubChem CID84661437
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name6-(azetidin-3-yloxy)-1H-indole
SMILESc1cc2ccc(OC3CNC3)cc2[nH]1
InChIInChI=1S/C11H12N2O/c1-2-9(14-10-6-12-7-10)5-11-8(1)3-4-13-11/h1-5,10,12-13H,6-7H2
InChIKeyRVPZDKPAVJWIIJ-UHFFFAOYSA-N
XLogP1.52
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-(azetidin-3-yloxy)-1H-indole 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 6-(azetidin-3-yloxy)-1H-indole?
The IUPAC name of 6-(azetidin-3-yloxy)-1H-indole (CID 84661437) is 6-(azetidin-3-yloxy)-1H-indole.
What is the SMILES notation for 6-(azetidin-3-yloxy)-1H-indole?
The canonical SMILES for 6-(azetidin-3-yloxy)-1H-indole is c1cc2ccc(OC3CNC3)cc2[nH]1.
What is the InChIKey of 6-(azetidin-3-yloxy)-1H-indole?
The InChIKey is RVPZDKPAVJWIIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-2-9(14-10-6-12-7-10)5-11-8(1)3-4-13-11/h1-5,10,12-13H,6-7H2.
What are the key properties of 6-(azetidin-3-yloxy)-1H-indole?
6-(azetidin-3-yloxy)-1H-indole has a molecular weight of 188.23 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(azetidin-3-yloxy)-1H-indole is sourced from PubChem (CID 84661437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).