5,8-diazaspiro[3.5]nonane;dihydrochloride

C7H16Cl2N2 — CID 44890855

IUPAC5,8-diazaspiro[3.5]nonane;dihydrochloride
SMILESC1CC2(C1)CNCCN2.Cl.Cl
InChIInChI=1S/C7H14N2.2ClH/c1-2-7(3-1)6-8-4-5-9-7;;/h8-9H,1-6H2;2*1H
InChIKeyZPIFZUKPOVZOCR-UHFFFAOYSA-N
MW199.12 g/mol
LogP0.95
Rot. Bonds

About 5,8-diazaspiro[3.5]nonane;dihydrochloride

5,8-diazaspiro[3.5]nonane;dihydrochloride (PubChem CID 44890855) has the molecular formula C7H16Cl2N2 and a molecular weight of 199.12 g/mol. Its IUPAC name is 5,8-diazaspiro[3.5]nonane;dihydrochloride.

Molecular Properties

Compound Name5,8-diazaspiro[3.5]nonane;dihydrochloride
PubChem CID44890855
Molecular FormulaC7H16Cl2N2
Molecular Weight199.12 g/mol
Exact Mass198.07
IUPAC Name5,8-diazaspiro[3.5]nonane;dihydrochloride
SMILESC1CC2(C1)CNCCN2.Cl.Cl
InChIInChI=1S/C7H14N2.2ClH/c1-2-7(3-1)6-8-4-5-9-7;;/h8-9H,1-6H2;2*1H
InChIKeyZPIFZUKPOVZOCR-UHFFFAOYSA-N
XLogP0.95
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.12
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,8-diazaspiro[3.5]nonane;dihydrochloride?
The IUPAC name of 5,8-diazaspiro[3.5]nonane;dihydrochloride (CID 44890855) is 5,8-diazaspiro[3.5]nonane;dihydrochloride.
What is the SMILES notation for 5,8-diazaspiro[3.5]nonane;dihydrochloride?
The canonical SMILES for 5,8-diazaspiro[3.5]nonane;dihydrochloride is C1CC2(C1)CNCCN2.Cl.Cl.
What is the InChIKey of 5,8-diazaspiro[3.5]nonane;dihydrochloride?
The InChIKey is ZPIFZUKPOVZOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.2ClH/c1-2-7(3-1)6-8-4-5-9-7;;/h8-9H,1-6H2;2*1H.
What are the key properties of 5,8-diazaspiro[3.5]nonane;dihydrochloride?
5,8-diazaspiro[3.5]nonane;dihydrochloride has a molecular weight of 199.12 g/mol, XLogP of 0.95, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-diazaspiro[3.5]nonane;dihydrochloride is sourced from PubChem (CID 44890855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).