(6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride

C7H14ClNO — CID 155683307

IUPAC(6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride
SMILESCl.O[C@H]1CCC2(CNC2)C1
InChIInChI=1S/C7H13NO.ClH/c9-6-1-2-7(3-6)4-8-5-7;/h6,8-9H,1-5H2;1H/t6-;/m0./s1
InChIKeyJADQMCHEFMSALL-RGMNGODLSA-N
MW163.65 g/mol
LogP0.54
Rot. Bonds

About (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride

(6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride (PubChem CID 155683307) has the molecular formula C7H14ClNO and a molecular weight of 163.65 g/mol. Its IUPAC name is (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride.

Molecular Properties

Compound Name(6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride
PubChem CID155683307
Molecular FormulaC7H14ClNO
Molecular Weight163.65 g/mol
Exact Mass163.08
IUPAC Name(6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride
SMILESCl.O[C@H]1CCC2(CNC2)C1
InChIInChI=1S/C7H13NO.ClH/c9-6-1-2-7(3-6)4-8-5-7;/h6,8-9H,1-5H2;1H/t6-;/m0./s1
InChIKeyJADQMCHEFMSALL-RGMNGODLSA-N
XLogP0.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.65
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride?
The IUPAC name of (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride (CID 155683307) is (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride.
What is the SMILES notation for (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride?
The canonical SMILES for (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride is Cl.O[C@H]1CCC2(CNC2)C1.
What is the InChIKey of (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride?
The InChIKey is JADQMCHEFMSALL-RGMNGODLSA-N. The full InChI is InChI=1S/C7H13NO.ClH/c9-6-1-2-7(3-6)4-8-5-7;/h6,8-9H,1-5H2;1H/t6-;/m0./s1.
What are the key properties of (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride?
(6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride has a molecular weight of 163.65 g/mol, XLogP of 0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-azaspiro[3.4]octan-6-ol;hydrochloride is sourced from PubChem (CID 155683307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).