5-azaspiro[3.4]octan-8-ol;hydrochloride

C7H14ClNO — CID 138990968

IUPAC5-azaspiro[3.4]octan-8-ol;hydrochloride
SMILESCl.OC1CCNC12CCC2
InChIInChI=1S/C7H13NO.ClH/c9-6-2-5-8-7(6)3-1-4-7;/h6,8-9H,1-5H2;1H
InChIKeyKVQDKRAOFWRVPC-UHFFFAOYSA-N
MW163.65 g/mol
LogP0.69
Rot. Bonds

About 5-azaspiro[3.4]octan-8-ol;hydrochloride

5-azaspiro[3.4]octan-8-ol;hydrochloride (PubChem CID 138990968) has the molecular formula C7H14ClNO and a molecular weight of 163.65 g/mol. Its IUPAC name is 5-azaspiro[3.4]octan-8-ol;hydrochloride.

Molecular Properties

Compound Name5-azaspiro[3.4]octan-8-ol;hydrochloride
PubChem CID138990968
Molecular FormulaC7H14ClNO
Molecular Weight163.65 g/mol
Exact Mass163.08
IUPAC Name5-azaspiro[3.4]octan-8-ol;hydrochloride
SMILESCl.OC1CCNC12CCC2
InChIInChI=1S/C7H13NO.ClH/c9-6-2-5-8-7(6)3-1-4-7;/h6,8-9H,1-5H2;1H
InChIKeyKVQDKRAOFWRVPC-UHFFFAOYSA-N
XLogP0.69
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 ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-azaspiro[3.4]octan-8-ol;hydrochloride?
The IUPAC name of 5-azaspiro[3.4]octan-8-ol;hydrochloride (CID 138990968) is 5-azaspiro[3.4]octan-8-ol;hydrochloride.
What is the SMILES notation for 5-azaspiro[3.4]octan-8-ol;hydrochloride?
The canonical SMILES for 5-azaspiro[3.4]octan-8-ol;hydrochloride is Cl.OC1CCNC12CCC2.
What is the InChIKey of 5-azaspiro[3.4]octan-8-ol;hydrochloride?
The InChIKey is KVQDKRAOFWRVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO.ClH/c9-6-2-5-8-7(6)3-1-4-7;/h6,8-9H,1-5H2;1H.
What are the key properties of 5-azaspiro[3.4]octan-8-ol;hydrochloride?
5-azaspiro[3.4]octan-8-ol;hydrochloride has a molecular weight of 163.65 g/mol, XLogP of 0.69, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-azaspiro[3.4]octan-8-ol;hydrochloride is sourced from PubChem (CID 138990968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).