3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione

C16H26N2O3 — CID 64901492

IUPAC3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCC1NC(=O)C2(CCCCC2)N(CC2CCOC2)C1=O
InChIInChI=1S/C16H26N2O3/c1-2-13-14(19)18(10-12-6-9-21-11-12)16(15(20)17-13)7-4-3-5-8-16/h12-13H,2-11H2,1H3,(H,17,20)
InChIKeyNUOFIUDCSJBIFD-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.46
Rot. Bonds3

About 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione

3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64901492) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64901492
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC Name3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCC1NC(=O)C2(CCCCC2)N(CC2CCOC2)C1=O
InChIInChI=1S/C16H26N2O3/c1-2-13-14(19)18(10-12-6-9-21-11-12)16(15(20)17-13)7-4-3-5-8-16/h12-13H,2-11H2,1H3,(H,17,20)
InChIKeyNUOFIUDCSJBIFD-UHFFFAOYSA-N
XLogP1.46
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione 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-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64901492) is 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione is CCC1NC(=O)C2(CCCCC2)N(CC2CCOC2)C1=O.
What is the InChIKey of 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is NUOFIUDCSJBIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-2-13-14(19)18(10-12-6-9-21-11-12)16(15(20)17-13)7-4-3-5-8-16/h12-13H,2-11H2,1H3,(H,17,20).
What are the key properties of 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 294.40 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(oxolan-3-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64901492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).