3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one

C14H24N2O3 — CID 70758915

IUPAC3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCCN1CC2(CCN(CC3CCCO3)CC2)OC1=O
InChIInChI=1S/C14H24N2O3/c1-2-16-11-14(19-13(16)17)5-7-15(8-6-14)10-12-4-3-9-18-12/h12H,2-11H2,1H3
InChIKeyUPFSYWZNODUCLI-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.47
Rot. Bonds3

About 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one

3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one (PubChem CID 70758915) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
PubChem CID70758915
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCCN1CC2(CCN(CC3CCCO3)CC2)OC1=O
InChIInChI=1S/C14H24N2O3/c1-2-16-11-14(19-13(16)17)5-7-15(8-6-14)10-12-4-3-9-18-12/h12H,2-11H2,1H3
InChIKeyUPFSYWZNODUCLI-UHFFFAOYSA-N
XLogP1.47
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-ethyl-8-(oxolan-2-ylmethyl)-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 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one (CID 70758915) is 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one is CCN1CC2(CCN(CC3CCCO3)CC2)OC1=O.
What is the InChIKey of 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The InChIKey is UPFSYWZNODUCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-2-16-11-14(19-13(16)17)5-7-15(8-6-14)10-12-4-3-9-18-12/h12H,2-11H2,1H3.
What are the key properties of 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one has a molecular weight of 268.36 g/mol, XLogP of 1.47, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-8-(oxolan-2-ylmethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 70758915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).