spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride

C10H17ClN2O2 — CID 91812266

IUPACspiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride
SMILESCl.O=C1COC2(CN1)CC1CCC(C2)N1
InChIInChI=1S/C10H16N2O2.ClH/c13-9-5-14-10(6-11-9)3-7-1-2-8(4-10)12-7;/h7-8,12H,1-6H2,(H,11,13);1H
InChIKeyYVDFFEBGIHIXBT-UHFFFAOYSA-N
MW232.71 g/mol
LogP0.21
Rot. Bonds

About spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride

spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride (PubChem CID 91812266) has the molecular formula C10H17ClN2O2 and a molecular weight of 232.71 g/mol. Its IUPAC name is spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride.

Molecular Properties

Compound Namespiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride
PubChem CID91812266
Molecular FormulaC10H17ClN2O2
Molecular Weight232.71 g/mol
Exact Mass232.10
IUPAC Namespiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride
SMILESCl.O=C1COC2(CN1)CC1CCC(C2)N1
InChIInChI=1S/C10H16N2O2.ClH/c13-9-5-14-10(6-11-9)3-7-1-2-8(4-10)12-7;/h7-8,12H,1-6H2,(H,11,13);1H
InChIKeyYVDFFEBGIHIXBT-UHFFFAOYSA-N
XLogP0.21
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4'-Methyl-8-azaspiro[bicyclo[3.2.1]octane-3,2'-morpholin]-5'-one hydrochloride
CID 91812251
4'-Cyclopropyl-8-azaspiro[bicyclo[3.2.1]octane-3,2'-morpholin]-5'-one hydrochloride
CID 91812255
4'-(Tert-butyl)-8-azaspiro[bicyclo[3.2.1]octane-3,2'-morpholin]-5'-one hydrochloride
CID 91812262
5-Butyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 20522027
Tert-butyl 3'-oxospiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine]-8-carboxylate
CID 121315701
tert-butyl (1S,5R)-3'-oxospiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine]-8-carboxylate
CID 121344145
5-Propyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 152781506
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2-piperidin-4-yloxyacetamide
CID 63876569
2-[(1-aminocycloheptyl)methoxy]-N-(oxan-4-yl)acetamide
CID 64549568
2-[1-(aminomethyl)cycloheptyl]oxy-N-(oxan-4-yl)acetamide
CID 65051806
2-[1-(aminomethyl)cycloheptyl]oxy-N-cyclopentylacetamide
CID 65052072
tert-butyl rac-(1R,3r,5S)-8H-spiro[8-azabicyclo[3.2.1]octane-3,2'-[1,4]oxazinane]-8-carboxylate
CID 74788379

Frequently Asked Questions

What is the IUPAC name of spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride?
The IUPAC name of spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride (CID 91812266) is spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride.
What is the SMILES notation for spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride?
The canonical SMILES for spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride is Cl.O=C1COC2(CN1)CC1CCC(C2)N1.
What is the InChIKey of spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride?
The InChIKey is YVDFFEBGIHIXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2.ClH/c13-9-5-14-10(6-11-9)3-7-1-2-8(4-10)12-7;/h7-8,12H,1-6H2,(H,11,13);1H.
What are the key properties of spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride?
spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride has a molecular weight of 232.71 g/mol, XLogP of 0.21, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[8-azabicyclo[3.2.1]octane-3,6'-morpholine]-3'-one;hydrochloride is sourced from PubChem (CID 91812266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).