7-azaspiro[4.6]undeca-3,9-diene

C10H15N — CID 23598603

IUPAC7-azaspiro[4.6]undeca-3,9-diene
SMILESC1=CC2(CC=CCNC2)CC1
InChIInChI=1S/C10H15N/c1-2-6-10(5-1)7-3-4-8-11-9-10/h1,3-5,11H,2,6-9H2
InChIKeyQFAKLHBCKQASPF-UHFFFAOYSA-N
MW149.24 g/mol
LogP1.87
Rot. Bonds

About 7-azaspiro[4.6]undeca-3,9-diene

7-azaspiro[4.6]undeca-3,9-diene (PubChem CID 23598603) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 7-azaspiro[4.6]undeca-3,9-diene.

Molecular Properties

Compound Name7-azaspiro[4.6]undeca-3,9-diene
PubChem CID23598603
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name7-azaspiro[4.6]undeca-3,9-diene
SMILESC1=CC2(CC=CCNC2)CC1
InChIInChI=1S/C10H15N/c1-2-6-10(5-1)7-3-4-8-11-9-10/h1,3-5,11H,2,6-9H2
InChIKeyQFAKLHBCKQASPF-UHFFFAOYSA-N
XLogP1.87
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 7-azaspiro[4.6]undeca-3,9-diene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 138006721
CID 138006721
CID 14139782
CID 14139782
CID 123800663
CID 123800663
CID 138006722
CID 138006722
CID 15668609
CID 15668609
CID 19893704
CID 19893704
CID 22000189
CID 22000189
CID 22341335
CID 22341335
CID 22975720
CID 22975720
CID 23135270
CID 23135270
CID 23135340
CID 23135340
CID 23135409
CID 23135409

Frequently Asked Questions

What is the IUPAC name of 7-azaspiro[4.6]undeca-3,9-diene?
The IUPAC name of 7-azaspiro[4.6]undeca-3,9-diene (CID 23598603) is 7-azaspiro[4.6]undeca-3,9-diene.
What is the SMILES notation for 7-azaspiro[4.6]undeca-3,9-diene?
The canonical SMILES for 7-azaspiro[4.6]undeca-3,9-diene is C1=CC2(CC=CCNC2)CC1.
What is the InChIKey of 7-azaspiro[4.6]undeca-3,9-diene?
The InChIKey is QFAKLHBCKQASPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-2-6-10(5-1)7-3-4-8-11-9-10/h1,3-5,11H,2,6-9H2.
What are the key properties of 7-azaspiro[4.6]undeca-3,9-diene?
7-azaspiro[4.6]undeca-3,9-diene has a molecular weight of 149.24 g/mol, XLogP of 1.87, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-azaspiro[4.6]undeca-3,9-diene is sourced from PubChem (CID 23598603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).