3,8-diazaspiro[5.6]dodec-10-ene

C10H18N2 — CID 23135202

IUPAC3,8-diazaspiro[5.6]dodec-10-ene
SMILESC1=CCC2(CCNCC2)CNC1
InChIInChI=1S/C10H18N2/c1-2-6-12-9-10(3-1)4-7-11-8-5-10/h1-2,11-12H,3-9H2
InChIKeyHLQDYWOYTYZTDK-UHFFFAOYSA-N
MW166.27 g/mol
LogP0.91
Rot. Bonds

About 3,8-diazaspiro[5.6]dodec-10-ene

3,8-diazaspiro[5.6]dodec-10-ene (PubChem CID 23135202) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 3,8-diazaspiro[5.6]dodec-10-ene.

Molecular Properties

Compound Name3,8-diazaspiro[5.6]dodec-10-ene
PubChem CID23135202
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name3,8-diazaspiro[5.6]dodec-10-ene
SMILESC1=CCC2(CCNCC2)CNC1
InChIInChI=1S/C10H18N2/c1-2-6-12-9-10(3-1)4-7-11-8-5-10/h1-2,11-12H,3-9H2
InChIKeyHLQDYWOYTYZTDK-UHFFFAOYSA-N
XLogP0.91
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 3,8-diazaspiro[5.6]dodec-10-ene?
The IUPAC name of 3,8-diazaspiro[5.6]dodec-10-ene (CID 23135202) is 3,8-diazaspiro[5.6]dodec-10-ene.
What is the SMILES notation for 3,8-diazaspiro[5.6]dodec-10-ene?
The canonical SMILES for 3,8-diazaspiro[5.6]dodec-10-ene is C1=CCC2(CCNCC2)CNC1.
What is the InChIKey of 3,8-diazaspiro[5.6]dodec-10-ene?
The InChIKey is HLQDYWOYTYZTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-6-12-9-10(3-1)4-7-11-8-5-10/h1-2,11-12H,3-9H2.
What are the key properties of 3,8-diazaspiro[5.6]dodec-10-ene?
3,8-diazaspiro[5.6]dodec-10-ene has a molecular weight of 166.27 g/mol, XLogP of 0.91, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-diazaspiro[5.6]dodec-10-ene is sourced from PubChem (CID 23135202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).