4-azaspiro[2.5]octane;hydrochloride

C7H14ClN — CID 71743378

IUPAC4-azaspiro[2.5]octane;hydrochloride
SMILESC1CCC2(CC2)NC1.Cl
InChIInChI=1S/C7H13N.ClH/c1-2-6-8-7(3-1)4-5-7;/h8H,1-6H2;1H
InChIKeyLQXHUZSSKFWQPZ-UHFFFAOYSA-N
MW147.65 g/mol
LogP1.71
Rot. Bonds

About 4-azaspiro[2.5]octane;hydrochloride

4-azaspiro[2.5]octane;hydrochloride (PubChem CID 71743378) has the molecular formula C7H14ClN and a molecular weight of 147.65 g/mol. Its IUPAC name is 4-azaspiro[2.5]octane;hydrochloride.

Molecular Properties

Compound Name4-azaspiro[2.5]octane;hydrochloride
PubChem CID71743378
Molecular FormulaC7H14ClN
Molecular Weight147.65 g/mol
Exact Mass147.08
IUPAC Name4-azaspiro[2.5]octane;hydrochloride
SMILESC1CCC2(CC2)NC1.Cl
InChIInChI=1S/C7H13N.ClH/c1-2-6-8-7(3-1)4-5-7;/h8H,1-6H2;1H
InChIKeyLQXHUZSSKFWQPZ-UHFFFAOYSA-N
XLogP1.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.65
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-azaspiro[2.5]octane;hydrochloride?
The IUPAC name of 4-azaspiro[2.5]octane;hydrochloride (CID 71743378) is 4-azaspiro[2.5]octane;hydrochloride.
What is the SMILES notation for 4-azaspiro[2.5]octane;hydrochloride?
The canonical SMILES for 4-azaspiro[2.5]octane;hydrochloride is C1CCC2(CC2)NC1.Cl.
What is the InChIKey of 4-azaspiro[2.5]octane;hydrochloride?
The InChIKey is LQXHUZSSKFWQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N.ClH/c1-2-6-8-7(3-1)4-5-7;/h8H,1-6H2;1H.
What are the key properties of 4-azaspiro[2.5]octane;hydrochloride?
4-azaspiro[2.5]octane;hydrochloride has a molecular weight of 147.65 g/mol, XLogP of 1.71, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-azaspiro[2.5]octane;hydrochloride is sourced from PubChem (CID 71743378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).