2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane

C13H25NO — CID 139298951

IUPAC2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane
SMILESCC1CC2(CCN(C(C)C)CC2)OC1C
InChIInChI=1S/C13H25NO/c1-10(2)14-7-5-13(6-8-14)9-11(3)12(4)15-13/h10-12H,5-9H2,1-4H3
InChIKeyHYPLNCMCNIXNKJ-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.67
Rot. Bonds1

About 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane

2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane (PubChem CID 139298951) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane
PubChem CID139298951
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane
SMILESCC1CC2(CCN(C(C)C)CC2)OC1C
InChIInChI=1S/C13H25NO/c1-10(2)14-7-5-13(6-8-14)9-11(3)12(4)15-13/h10-12H,5-9H2,1-4H3
InChIKeyHYPLNCMCNIXNKJ-UHFFFAOYSA-N
XLogP2.67
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane (CID 139298951) is 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane is CC1CC2(CCN(C(C)C)CC2)OC1C.
What is the InChIKey of 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is HYPLNCMCNIXNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-10(2)14-7-5-13(6-8-14)9-11(3)12(4)15-13/h10-12H,5-9H2,1-4H3.
What are the key properties of 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane?
2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 211.35 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-8-propan-2-yl-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 139298951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).