1-oxa-10-azaspiro[5.6]dodecane;hydrochloride

C10H20ClNO — CID 167725884

IUPAC1-oxa-10-azaspiro[5.6]dodecane;hydrochloride
SMILESC1CCC2(CCCNCC2)OC1.Cl
InChIInChI=1S/C10H19NO.ClH/c1-2-9-12-10(4-1)5-3-7-11-8-6-10;/h11H,1-9H2;1H
InChIKeyIVDJCZNRWDUXFS-UHFFFAOYSA-N
MW205.73 g/mol
LogP2.12
Rot. Bonds

About 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride

1-oxa-10-azaspiro[5.6]dodecane;hydrochloride (PubChem CID 167725884) has the molecular formula C10H20ClNO and a molecular weight of 205.73 g/mol. Its IUPAC name is 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride.

Molecular Properties

Compound Name1-oxa-10-azaspiro[5.6]dodecane;hydrochloride
PubChem CID167725884
Molecular FormulaC10H20ClNO
Molecular Weight205.73 g/mol
Exact Mass205.12
IUPAC Name1-oxa-10-azaspiro[5.6]dodecane;hydrochloride
SMILESC1CCC2(CCCNCC2)OC1.Cl
InChIInChI=1S/C10H19NO.ClH/c1-2-9-12-10(4-1)5-3-7-11-8-6-10;/h11H,1-9H2;1H
InChIKeyIVDJCZNRWDUXFS-UHFFFAOYSA-N
XLogP2.12
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.73
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride?
The IUPAC name of 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride (CID 167725884) is 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride.
What is the SMILES notation for 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride?
The canonical SMILES for 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride is C1CCC2(CCCNCC2)OC1.Cl.
What is the InChIKey of 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride?
The InChIKey is IVDJCZNRWDUXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.ClH/c1-2-9-12-10(4-1)5-3-7-11-8-6-10;/h11H,1-9H2;1H.
What are the key properties of 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride?
1-oxa-10-azaspiro[5.6]dodecane;hydrochloride has a molecular weight of 205.73 g/mol, XLogP of 2.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-10-azaspiro[5.6]dodecane;hydrochloride is sourced from PubChem (CID 167725884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).