8-azaspiro[5.6]dodeca-4,10-diene

C11H17N — CID 23598605

IUPAC8-azaspiro[5.6]dodeca-4,10-diene
SMILESC1=CC2(CC=CCNC2)CCC1
InChIInChI=1S/C11H17N/c1-2-6-11(7-3-1)8-4-5-9-12-10-11/h2,4-6,12H,1,3,7-10H2
InChIKeyRUUOZHKEWWKJCR-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.26
Rot. Bonds

About 8-azaspiro[5.6]dodeca-4,10-diene

8-azaspiro[5.6]dodeca-4,10-diene (PubChem CID 23598605) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 8-azaspiro[5.6]dodeca-4,10-diene.

Molecular Properties

Compound Name8-azaspiro[5.6]dodeca-4,10-diene
PubChem CID23598605
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name8-azaspiro[5.6]dodeca-4,10-diene
SMILESC1=CC2(CC=CCNC2)CCC1
InChIInChI=1S/C11H17N/c1-2-6-11(7-3-1)8-4-5-9-12-10-11/h2,4-6,12H,1,3,7-10H2
InChIKeyRUUOZHKEWWKJCR-UHFFFAOYSA-N
XLogP2.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.26
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[5.6]dodeca-4,10-diene?
The IUPAC name of 8-azaspiro[5.6]dodeca-4,10-diene (CID 23598605) is 8-azaspiro[5.6]dodeca-4,10-diene.
What is the SMILES notation for 8-azaspiro[5.6]dodeca-4,10-diene?
The canonical SMILES for 8-azaspiro[5.6]dodeca-4,10-diene is C1=CC2(CC=CCNC2)CCC1.
What is the InChIKey of 8-azaspiro[5.6]dodeca-4,10-diene?
The InChIKey is RUUOZHKEWWKJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-2-6-11(7-3-1)8-4-5-9-12-10-11/h2,4-6,12H,1,3,7-10H2.
What are the key properties of 8-azaspiro[5.6]dodeca-4,10-diene?
8-azaspiro[5.6]dodeca-4,10-diene has a molecular weight of 163.26 g/mol, XLogP of 2.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azaspiro[5.6]dodeca-4,10-diene is sourced from PubChem (CID 23598605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).