2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane

C11H21NO — CID 59764735

IUPAC2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane
SMILESCC(C)N1CCC2(CCOCC2)C1
InChIInChI=1S/C11H21NO/c1-10(2)12-6-3-11(9-12)4-7-13-8-5-11/h10H,3-9H2,1-2H3
InChIKeyODAVPQOTDHQFRG-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds1

About 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane

2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane (PubChem CID 59764735) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane
PubChem CID59764735
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane
SMILESCC(C)N1CCC2(CCOCC2)C1
InChIInChI=1S/C11H21NO/c1-10(2)12-6-3-11(9-12)4-7-13-8-5-11/h10H,3-9H2,1-2H3
InChIKeyODAVPQOTDHQFRG-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-propan-2-yl-8-oxa-2-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 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane?
The IUPAC name of 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane (CID 59764735) is 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane.
What is the SMILES notation for 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane?
The canonical SMILES for 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane is CC(C)N1CCC2(CCOCC2)C1.
What is the InChIKey of 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane?
The InChIKey is ODAVPQOTDHQFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)12-6-3-11(9-12)4-7-13-8-5-11/h10H,3-9H2,1-2H3.
What are the key properties of 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane?
2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane has a molecular weight of 183.29 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-8-oxa-2-azaspiro[4.5]decane is sourced from PubChem (CID 59764735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).