7-oxa-4-azaspiro[2.5]octane;hydrochloride

C6H12ClNO — CID 22342972

IUPAC7-oxa-4-azaspiro[2.5]octane;hydrochloride
SMILESC1COCC2(CC2)N1.Cl
InChIInChI=1S/C6H11NO.ClH/c1-2-6(1)5-8-4-3-7-6;/h7H,1-5H2;1H
InChIKeyCSEXKWFDRVXMFU-UHFFFAOYSA-N
MW149.62 g/mol
LogP0.56
Rot. Bonds

About 7-oxa-4-azaspiro[2.5]octane;hydrochloride

7-oxa-4-azaspiro[2.5]octane;hydrochloride (PubChem CID 22342972) has the molecular formula C6H12ClNO and a molecular weight of 149.62 g/mol. Its IUPAC name is 7-oxa-4-azaspiro[2.5]octane;hydrochloride.

Molecular Properties

Compound Name7-oxa-4-azaspiro[2.5]octane;hydrochloride
PubChem CID22342972
Molecular FormulaC6H12ClNO
Molecular Weight149.62 g/mol
Exact Mass149.06
IUPAC Name7-oxa-4-azaspiro[2.5]octane;hydrochloride
SMILESC1COCC2(CC2)N1.Cl
InChIInChI=1S/C6H11NO.ClH/c1-2-6(1)5-8-4-3-7-6;/h7H,1-5H2;1H
InChIKeyCSEXKWFDRVXMFU-UHFFFAOYSA-N
XLogP0.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.62
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-oxa-4-azaspiro[2.6]nonane;hydrochloride
CID 119031117
7,10-dioxa-1-azaspiro[4.6]undecane
CID 118210203
10-oxa-1,7-diazaspiro[4.6]undecane
CID 118210142
bis(7-oxa-1-azaspiro[3.4]octane);oxalic acid
CID 91663917
2,10-dioxa-6-azaspiro[4.6]undecane
CID 118209581
bis(7-oxa-1-azaspiro[3.4]octane);oxalate
CID 122714495
2-oxa-5-azaspiro[3.4]octane;hydrochloride
CID 163197887
2-tert-butyl-9-oxa-2,6-diazaspiro[4.5]decane
CID 162462266
7-oxa-1-azaspiro[3.5]nonane;hydrochloride
CID 122163983
9-benzyl-4-oxa-1,9-diazaspiro[5.5]undecane
CID 58299624
2-oxa-5-azaspiro[3.4]octane
CID 54759126
2-oxa-5,8-diazaspiro[3.7]undecane
CID 118210062

Frequently Asked Questions

What is the IUPAC name of 7-oxa-4-azaspiro[2.5]octane;hydrochloride?
The IUPAC name of 7-oxa-4-azaspiro[2.5]octane;hydrochloride (CID 22342972) is 7-oxa-4-azaspiro[2.5]octane;hydrochloride.
What is the SMILES notation for 7-oxa-4-azaspiro[2.5]octane;hydrochloride?
The canonical SMILES for 7-oxa-4-azaspiro[2.5]octane;hydrochloride is C1COCC2(CC2)N1.Cl.
What is the InChIKey of 7-oxa-4-azaspiro[2.5]octane;hydrochloride?
The InChIKey is CSEXKWFDRVXMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.ClH/c1-2-6(1)5-8-4-3-7-6;/h7H,1-5H2;1H.
What are the key properties of 7-oxa-4-azaspiro[2.5]octane;hydrochloride?
7-oxa-4-azaspiro[2.5]octane;hydrochloride has a molecular weight of 149.62 g/mol, XLogP of 0.56, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxa-4-azaspiro[2.5]octane;hydrochloride is sourced from PubChem (CID 22342972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).