9-azadispiro[2.2.56.23]tridecane;hydrochloride

C12H22ClN — CID 155487193

IUPAC9-azadispiro[2.2.56.23]tridecane;hydrochloride
SMILESC1CC2(CCN1)CCC1(CC2)CC1.Cl
InChIInChI=1S/C12H21N.ClH/c1-2-11(1)3-5-12(6-4-11)7-9-13-10-8-12;/h13H,1-10H2;1H
InChIKeyPYVVYWNLSKLCIV-UHFFFAOYSA-N
MW215.77 g/mol
LogP3.13
Rot. Bonds

About 9-azadispiro[2.2.56.23]tridecane;hydrochloride

9-azadispiro[2.2.56.23]tridecane;hydrochloride (PubChem CID 155487193) has the molecular formula C12H22ClN and a molecular weight of 215.77 g/mol. Its IUPAC name is 9-azadispiro[2.2.56.23]tridecane;hydrochloride.

Molecular Properties

Compound Name9-azadispiro[2.2.56.23]tridecane;hydrochloride
PubChem CID155487193
Molecular FormulaC12H22ClN
Molecular Weight215.77 g/mol
Exact Mass215.14
IUPAC Name9-azadispiro[2.2.56.23]tridecane;hydrochloride
SMILESC1CC2(CCN1)CCC1(CC2)CC1.Cl
InChIInChI=1S/C12H21N.ClH/c1-2-11(1)3-5-12(6-4-11)7-9-13-10-8-12;/h13H,1-10H2;1H
InChIKeyPYVVYWNLSKLCIV-UHFFFAOYSA-N
XLogP3.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.77
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2,8-diazaspiro[4.5]decane;ethane
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methane;bis(3-methyl-3,9-diazaspiro[5.5]undecane)
CID 158463391
2-thia-9-azaspiro[5.5]undecane;hydrochloride
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3,9-diazaspiro[5.5]undecane;1,4-dioxaspiro[4.5]decane
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Frequently Asked Questions

What is the IUPAC name of 9-azadispiro[2.2.56.23]tridecane;hydrochloride?
The IUPAC name of 9-azadispiro[2.2.56.23]tridecane;hydrochloride (CID 155487193) is 9-azadispiro[2.2.56.23]tridecane;hydrochloride.
What is the SMILES notation for 9-azadispiro[2.2.56.23]tridecane;hydrochloride?
The canonical SMILES for 9-azadispiro[2.2.56.23]tridecane;hydrochloride is C1CC2(CCN1)CCC1(CC2)CC1.Cl.
What is the InChIKey of 9-azadispiro[2.2.56.23]tridecane;hydrochloride?
The InChIKey is PYVVYWNLSKLCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N.ClH/c1-2-11(1)3-5-12(6-4-11)7-9-13-10-8-12;/h13H,1-10H2;1H.
What are the key properties of 9-azadispiro[2.2.56.23]tridecane;hydrochloride?
9-azadispiro[2.2.56.23]tridecane;hydrochloride has a molecular weight of 215.77 g/mol, XLogP of 3.13, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-azadispiro[2.2.56.23]tridecane;hydrochloride is sourced from PubChem (CID 155487193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).