8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane

C12H23NO — CID 59603524

IUPAC8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane
SMILESCC(C)CN1CCC2(CCCO2)CC1
InChIInChI=1S/C12H23NO/c1-11(2)10-13-7-5-12(6-8-13)4-3-9-14-12/h11H,3-10H2,1-2H3
InChIKeyINQLJJMBLMZIFA-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.29
Rot. Bonds2

About 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane

8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane (PubChem CID 59603524) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane
PubChem CID59603524
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane
SMILESCC(C)CN1CCC2(CCCO2)CC1
InChIInChI=1S/C12H23NO/c1-11(2)10-13-7-5-12(6-8-13)4-3-9-14-12/h11H,3-10H2,1-2H3
InChIKeyINQLJJMBLMZIFA-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane (CID 59603524) is 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane is CC(C)CN1CCC2(CCCO2)CC1.
What is the InChIKey of 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is INQLJJMBLMZIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-11(2)10-13-7-5-12(6-8-13)4-3-9-14-12/h11H,3-10H2,1-2H3.
What are the key properties of 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane?
8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 197.32 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methylpropyl)-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 59603524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).