3,8-diazaspiro[5.7]tridecane

C11H22N2 — CID 23282922

IUPAC3,8-diazaspiro[5.7]tridecane
SMILESC1CCNCC2(CC1)CCNCC2
InChIInChI=1S/C11H22N2/c1-2-4-11(10-13-7-3-1)5-8-12-9-6-11/h12-13H,1-10H2
InChIKeyKVJROPPEFOVJMW-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.52
Rot. Bonds

About 3,8-diazaspiro[5.7]tridecane

3,8-diazaspiro[5.7]tridecane (PubChem CID 23282922) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3,8-diazaspiro[5.7]tridecane.

Molecular Properties

Compound Name3,8-diazaspiro[5.7]tridecane
PubChem CID23282922
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3,8-diazaspiro[5.7]tridecane
SMILESC1CCNCC2(CC1)CCNCC2
InChIInChI=1S/C11H22N2/c1-2-4-11(10-13-7-3-1)5-8-12-9-6-11/h12-13H,1-10H2
InChIKeyKVJROPPEFOVJMW-UHFFFAOYSA-N
XLogP1.52
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,8-diazaspiro[5.7]tridecane?
The IUPAC name of 3,8-diazaspiro[5.7]tridecane (CID 23282922) is 3,8-diazaspiro[5.7]tridecane.
What is the SMILES notation for 3,8-diazaspiro[5.7]tridecane?
The canonical SMILES for 3,8-diazaspiro[5.7]tridecane is C1CCNCC2(CC1)CCNCC2.
What is the InChIKey of 3,8-diazaspiro[5.7]tridecane?
The InChIKey is KVJROPPEFOVJMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-4-11(10-13-7-3-1)5-8-12-9-6-11/h12-13H,1-10H2.
What are the key properties of 3,8-diazaspiro[5.7]tridecane?
3,8-diazaspiro[5.7]tridecane has a molecular weight of 182.31 g/mol, XLogP of 1.52, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-diazaspiro[5.7]tridecane is sourced from PubChem (CID 23282922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).