7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane

C10H19NO2 — CID 89255157

IUPAC7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane
SMILESCCC1CC2(CN1CC)OCCO2
InChIInChI=1S/C10H19NO2/c1-3-9-7-10(8-11(9)4-2)12-5-6-13-10/h9H,3-8H2,1-2H3
InChIKeyWETGWDJVKWJFKU-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.23
Rot. Bonds2

About 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane

7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane (PubChem CID 89255157) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Name7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane
PubChem CID89255157
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane
SMILESCCC1CC2(CN1CC)OCCO2
InChIInChI=1S/C10H19NO2/c1-3-9-7-10(8-11(9)4-2)12-5-6-13-10/h9H,3-8H2,1-2H3
InChIKeyWETGWDJVKWJFKU-UHFFFAOYSA-N
XLogP1.23
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane 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 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane?
The IUPAC name of 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane (CID 89255157) is 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane?
The canonical SMILES for 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane is CCC1CC2(CN1CC)OCCO2.
What is the InChIKey of 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane?
The InChIKey is WETGWDJVKWJFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-9-7-10(8-11(9)4-2)12-5-6-13-10/h9H,3-8H2,1-2H3.
What are the key properties of 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane?
7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane has a molecular weight of 185.27 g/mol, XLogP of 1.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-diethyl-1,4-dioxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 89255157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).