8-oxa-2-azaspiro[4.5]decane;hydrochloride

C8H16ClNO — CID 56777106

IUPAC8-oxa-2-azaspiro[4.5]decane;hydrochloride
SMILESC1CC2(CCOCC2)CN1.Cl
InChIInChI=1S/C8H15NO.ClH/c1-4-9-7-8(1)2-5-10-6-3-8;/h9H,1-7H2;1H
InChIKeyMJLGNFCIGGNZGV-UHFFFAOYSA-N
MW177.67 g/mol
LogP1.20
Rot. Bonds

About 8-oxa-2-azaspiro[4.5]decane;hydrochloride

8-oxa-2-azaspiro[4.5]decane;hydrochloride (PubChem CID 56777106) has the molecular formula C8H16ClNO and a molecular weight of 177.67 g/mol. Its IUPAC name is 8-oxa-2-azaspiro[4.5]decane;hydrochloride.

Molecular Properties

Compound Name8-oxa-2-azaspiro[4.5]decane;hydrochloride
PubChem CID56777106
Molecular FormulaC8H16ClNO
Molecular Weight177.67 g/mol
Exact Mass177.09
IUPAC Name8-oxa-2-azaspiro[4.5]decane;hydrochloride
SMILESC1CC2(CCOCC2)CN1.Cl
InChIInChI=1S/C8H15NO.ClH/c1-4-9-7-8(1)2-5-10-6-3-8;/h9H,1-7H2;1H
InChIKeyMJLGNFCIGGNZGV-UHFFFAOYSA-N
XLogP1.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.67
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-oxa-2-azaspiro[4.5]decane;hydrochloride?
The IUPAC name of 8-oxa-2-azaspiro[4.5]decane;hydrochloride (CID 56777106) is 8-oxa-2-azaspiro[4.5]decane;hydrochloride.
What is the SMILES notation for 8-oxa-2-azaspiro[4.5]decane;hydrochloride?
The canonical SMILES for 8-oxa-2-azaspiro[4.5]decane;hydrochloride is C1CC2(CCOCC2)CN1.Cl.
What is the InChIKey of 8-oxa-2-azaspiro[4.5]decane;hydrochloride?
The InChIKey is MJLGNFCIGGNZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.ClH/c1-4-9-7-8(1)2-5-10-6-3-8;/h9H,1-7H2;1H.
What are the key properties of 8-oxa-2-azaspiro[4.5]decane;hydrochloride?
8-oxa-2-azaspiro[4.5]decane;hydrochloride has a molecular weight of 177.67 g/mol, XLogP of 1.20, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-oxa-2-azaspiro[4.5]decane;hydrochloride is sourced from PubChem (CID 56777106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).