6-propyl-2-oxa-8-azaspiro[4.5]decane

C11H21NO — CID 79321500

IUPAC6-propyl-2-oxa-8-azaspiro[4.5]decane
SMILESCCCC1CNCCC12CCOC2
InChIInChI=1S/C11H21NO/c1-2-3-10-8-12-6-4-11(10)5-7-13-9-11/h10,12H,2-9H2,1H3
InChIKeyXAYFJAXIZIGAAK-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds2

About 6-propyl-2-oxa-8-azaspiro[4.5]decane

6-propyl-2-oxa-8-azaspiro[4.5]decane (PubChem CID 79321500) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 6-propyl-2-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name6-propyl-2-oxa-8-azaspiro[4.5]decane
PubChem CID79321500
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name6-propyl-2-oxa-8-azaspiro[4.5]decane
SMILESCCCC1CNCCC12CCOC2
InChIInChI=1S/C11H21NO/c1-2-3-10-8-12-6-4-11(10)5-7-13-9-11/h10,12H,2-9H2,1H3
InChIKeyXAYFJAXIZIGAAK-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-propyl-2-oxa-8-azaspiro[4.5]decane 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-propyl-2-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 6-propyl-2-oxa-8-azaspiro[4.5]decane (CID 79321500) is 6-propyl-2-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 6-propyl-2-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 6-propyl-2-oxa-8-azaspiro[4.5]decane is CCCC1CNCCC12CCOC2.
What is the InChIKey of 6-propyl-2-oxa-8-azaspiro[4.5]decane?
The InChIKey is XAYFJAXIZIGAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-3-10-8-12-6-4-11(10)5-7-13-9-11/h10,12H,2-9H2,1H3.
What are the key properties of 6-propyl-2-oxa-8-azaspiro[4.5]decane?
6-propyl-2-oxa-8-azaspiro[4.5]decane has a molecular weight of 183.29 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propyl-2-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 79321500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).