4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride

C14H27ClN2O — CID 91812264

IUPAC4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride
SMILESCC(C)(C)N1CCOC2(CC3CCC(C2)N3)C1.Cl
InChIInChI=1S/C14H26N2O.ClH/c1-13(2,3)16-6-7-17-14(10-16)8-11-4-5-12(9-14)15-11;/h11-12,15H,4-10H2,1-3H3;1H
InChIKeyOAYGGUZTQMKXBZ-UHFFFAOYSA-N
MW274.84 g/mol
LogP2.19
Rot. Bonds

About 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride

4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride (PubChem CID 91812264) has the molecular formula C14H27ClN2O and a molecular weight of 274.84 g/mol. Its IUPAC name is 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride.

Molecular Properties

Compound Name4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride
PubChem CID91812264
Molecular FormulaC14H27ClN2O
Molecular Weight274.84 g/mol
Exact Mass274.18
IUPAC Name4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride
SMILESCC(C)(C)N1CCOC2(CC3CCC(C2)N3)C1.Cl
InChIInChI=1S/C14H26N2O.ClH/c1-13(2,3)16-6-7-17-14(10-16)8-11-4-5-12(9-14)15-11;/h11-12,15H,4-10H2,1-3H3;1H
InChIKeyOAYGGUZTQMKXBZ-UHFFFAOYSA-N
XLogP2.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.84
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride?
The IUPAC name of 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride (CID 91812264) is 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride.
What is the SMILES notation for 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride?
The canonical SMILES for 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride is CC(C)(C)N1CCOC2(CC3CCC(C2)N3)C1.Cl.
What is the InChIKey of 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride?
The InChIKey is OAYGGUZTQMKXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O.ClH/c1-13(2,3)16-6-7-17-14(10-16)8-11-4-5-12(9-14)15-11;/h11-12,15H,4-10H2,1-3H3;1H.
What are the key properties of 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride?
4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride has a molecular weight of 274.84 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4'-tert-butylspiro[8-azabicyclo[3.2.1]octane-3,2'-morpholine];hydrochloride is sourced from PubChem (CID 91812264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).