8-azaspiro[4.5]dec-2-ene

C9H15N — CID 22341335

IUPAC8-azaspiro[4.5]dec-2-ene
SMILESC1=CCC2(C1)CCNCC2
InChIInChI=1S/C9H15N/c1-2-4-9(3-1)5-7-10-8-6-9/h1-2,10H,3-8H2
InChIKeyXUOBFFPGZFFAIT-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.71
Rot. Bonds

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

8-azaspiro[4.5]dec-2-ene (PubChem CID 22341335) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 8-azaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name8-azaspiro[4.5]dec-2-ene
PubChem CID22341335
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name8-azaspiro[4.5]dec-2-ene
SMILESC1=CCC2(C1)CCNCC2
InChIInChI=1S/C9H15N/c1-2-4-9(3-1)5-7-10-8-6-9/h1-2,10H,3-8H2
InChIKeyXUOBFFPGZFFAIT-UHFFFAOYSA-N
XLogP1.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-azaspiro[4.5]dec-2-ene?
The IUPAC name of 8-azaspiro[4.5]dec-2-ene (CID 22341335) is 8-azaspiro[4.5]dec-2-ene.
What is the SMILES notation for 8-azaspiro[4.5]dec-2-ene?
The canonical SMILES for 8-azaspiro[4.5]dec-2-ene is C1=CCC2(C1)CCNCC2.
What is the InChIKey of 8-azaspiro[4.5]dec-2-ene?
The InChIKey is XUOBFFPGZFFAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-2-4-9(3-1)5-7-10-8-6-9/h1-2,10H,3-8H2.
What are the key properties of 8-azaspiro[4.5]dec-2-ene?
8-azaspiro[4.5]dec-2-ene has a molecular weight of 137.23 g/mol, XLogP of 1.71, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azaspiro[4.5]dec-2-ene is sourced from PubChem (CID 22341335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).