8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one

C17H21N3O2 — CID 13016615

IUPAC8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESO=C1NCC2(CCN(CCc3c[nH]c4ccccc34)CC2)O1
InChIInChI=1S/C17H21N3O2/c21-16-19-12-17(22-16)6-9-20(10-7-17)8-5-13-11-18-15-4-2-1-3-14(13)15/h1-4,11,18H,5-10,12H2,(H,19,21)
InChIKeyRAZDWOMOWLCHDD-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.28
Rot. Bonds3

About 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one

8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one (PubChem CID 13016615) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
PubChem CID13016615
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESO=C1NCC2(CCN(CCc3c[nH]c4ccccc34)CC2)O1
InChIInChI=1S/C17H21N3O2/c21-16-19-12-17(22-16)6-9-20(10-7-17)8-5-13-11-18-15-4-2-1-3-14(13)15/h1-4,11,18H,5-10,12H2,(H,19,21)
InChIKeyRAZDWOMOWLCHDD-UHFFFAOYSA-N
XLogP2.28
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-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 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one (CID 13016615) is 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one is O=C1NCC2(CCN(CCc3c[nH]c4ccccc34)CC2)O1.
What is the InChIKey of 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The InChIKey is RAZDWOMOWLCHDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c21-16-19-12-17(22-16)6-9-20(10-7-17)8-5-13-11-18-15-4-2-1-3-14(13)15/h1-4,11,18H,5-10,12H2,(H,19,21).
What are the key properties of 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one has a molecular weight of 299.37 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(1H-indol-3-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 13016615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).