1,5-diazaspiro[3.6]deca-5,7,9-triene

C8H10N2 — CID 175799559

IUPAC1,5-diazaspiro[3.6]deca-5,7,9-triene
SMILESC1=CC=NC2(C=C1)CCN2
InChIInChI=1S/C8H10N2/c1-2-4-8(5-7-10-8)9-6-3-1/h1-4,6,10H,5,7H2
InChIKeyQSXQGZJJLZFEIU-UHFFFAOYSA-N
MW134.18 g/mol
LogP0.87
Rot. Bonds

About 1,5-diazaspiro[3.6]deca-5,7,9-triene

1,5-diazaspiro[3.6]deca-5,7,9-triene (PubChem CID 175799559) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 1,5-diazaspiro[3.6]deca-5,7,9-triene.

Molecular Properties

Compound Name1,5-diazaspiro[3.6]deca-5,7,9-triene
PubChem CID175799559
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name1,5-diazaspiro[3.6]deca-5,7,9-triene
SMILESC1=CC=NC2(C=C1)CCN2
InChIInChI=1S/C8H10N2/c1-2-4-8(5-7-10-8)9-6-3-1/h1-4,6,10H,5,7H2
InChIKeyQSXQGZJJLZFEIU-UHFFFAOYSA-N
XLogP0.87
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,5-diazaspiro[3.6]deca-5,7,9-triene?
The IUPAC name of 1,5-diazaspiro[3.6]deca-5,7,9-triene (CID 175799559) is 1,5-diazaspiro[3.6]deca-5,7,9-triene.
What is the SMILES notation for 1,5-diazaspiro[3.6]deca-5,7,9-triene?
The canonical SMILES for 1,5-diazaspiro[3.6]deca-5,7,9-triene is C1=CC=NC2(C=C1)CCN2.
What is the InChIKey of 1,5-diazaspiro[3.6]deca-5,7,9-triene?
The InChIKey is QSXQGZJJLZFEIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-2-4-8(5-7-10-8)9-6-3-1/h1-4,6,10H,5,7H2.
What are the key properties of 1,5-diazaspiro[3.6]deca-5,7,9-triene?
1,5-diazaspiro[3.6]deca-5,7,9-triene has a molecular weight of 134.18 g/mol, XLogP of 0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-diazaspiro[3.6]deca-5,7,9-triene is sourced from PubChem (CID 175799559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).