1-oxa-8-azaspiro[4.5]dec-2-ene

C8H13NO — CID 57124453

IUPAC1-oxa-8-azaspiro[4.5]dec-2-ene
SMILESC1=COC2(C1)CCNCC2
InChIInChI=1S/C8H13NO/c1-2-8(10-7-1)3-5-9-6-4-8/h1,7,9H,2-6H2
InChIKeyGMISICBBVUABPF-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.04
Rot. Bonds

About 1-oxa-8-azaspiro[4.5]dec-2-ene

1-oxa-8-azaspiro[4.5]dec-2-ene (PubChem CID 57124453) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 1-oxa-8-azaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name1-oxa-8-azaspiro[4.5]dec-2-ene
PubChem CID57124453
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name1-oxa-8-azaspiro[4.5]dec-2-ene
SMILESC1=COC2(C1)CCNCC2
InChIInChI=1S/C8H13NO/c1-2-8(10-7-1)3-5-9-6-4-8/h1,7,9H,2-6H2
InChIKeyGMISICBBVUABPF-UHFFFAOYSA-N
XLogP1.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Methoxy-4-prop-2-enylpiperidine
CID 91115657
2-Oxa-8-azaspiro[4.5]dec-3-ene
CID 141701201
4-[(Z)-3-ethenoxyprop-2-enyl]piperidine
CID 142245568

Frequently Asked Questions

What is the IUPAC name of 1-oxa-8-azaspiro[4.5]dec-2-ene?
The IUPAC name of 1-oxa-8-azaspiro[4.5]dec-2-ene (CID 57124453) is 1-oxa-8-azaspiro[4.5]dec-2-ene.
What is the SMILES notation for 1-oxa-8-azaspiro[4.5]dec-2-ene?
The canonical SMILES for 1-oxa-8-azaspiro[4.5]dec-2-ene is C1=COC2(C1)CCNCC2.
What is the InChIKey of 1-oxa-8-azaspiro[4.5]dec-2-ene?
The InChIKey is GMISICBBVUABPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-2-8(10-7-1)3-5-9-6-4-8/h1,7,9H,2-6H2.
What are the key properties of 1-oxa-8-azaspiro[4.5]dec-2-ene?
1-oxa-8-azaspiro[4.5]dec-2-ene has a molecular weight of 139.20 g/mol, XLogP of 1.04, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-8-azaspiro[4.5]dec-2-ene is sourced from PubChem (CID 57124453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).