3-azaspiro[5.5]undecane;hydrochloride

C10H20ClN — CID 22252831

IUPAC3-azaspiro[5.5]undecane;hydrochloride
SMILESC1CCC2(CC1)CCNCC2.Cl
InChIInChI=1S/C10H19N.ClH/c1-2-4-10(5-3-1)6-8-11-9-7-10;/h11H,1-9H2;1H
InChIKeyXDRWSBJRLMRJKA-UHFFFAOYSA-N
MW189.73 g/mol
LogP2.74
Rot. Bonds

About 3-azaspiro[5.5]undecane;hydrochloride

3-azaspiro[5.5]undecane;hydrochloride (PubChem CID 22252831) has the molecular formula C10H20ClN and a molecular weight of 189.73 g/mol. Its IUPAC name is 3-azaspiro[5.5]undecane;hydrochloride.

Molecular Properties

Compound Name3-azaspiro[5.5]undecane;hydrochloride
PubChem CID22252831
Molecular FormulaC10H20ClN
Molecular Weight189.73 g/mol
Exact Mass189.13
IUPAC Name3-azaspiro[5.5]undecane;hydrochloride
SMILESC1CCC2(CC1)CCNCC2.Cl
InChIInChI=1S/C10H19N.ClH/c1-2-4-10(5-3-1)6-8-11-9-7-10;/h11H,1-9H2;1H
InChIKeyXDRWSBJRLMRJKA-UHFFFAOYSA-N
XLogP2.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.73
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-azaspiro[5.5]undecane;hydrochloride?
The IUPAC name of 3-azaspiro[5.5]undecane;hydrochloride (CID 22252831) is 3-azaspiro[5.5]undecane;hydrochloride.
What is the SMILES notation for 3-azaspiro[5.5]undecane;hydrochloride?
The canonical SMILES for 3-azaspiro[5.5]undecane;hydrochloride is C1CCC2(CC1)CCNCC2.Cl.
What is the InChIKey of 3-azaspiro[5.5]undecane;hydrochloride?
The InChIKey is XDRWSBJRLMRJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N.ClH/c1-2-4-10(5-3-1)6-8-11-9-7-10;/h11H,1-9H2;1H.
What are the key properties of 3-azaspiro[5.5]undecane;hydrochloride?
3-azaspiro[5.5]undecane;hydrochloride has a molecular weight of 189.73 g/mol, XLogP of 2.74, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azaspiro[5.5]undecane;hydrochloride is sourced from PubChem (CID 22252831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).