10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane

C13H26N2O — CID 64942299

IUPAC10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane
SMILESCOCC(C)N1CCCNC2(CCCC2)C1
InChIInChI=1S/C13H26N2O/c1-12(10-16-2)15-9-5-8-14-13(11-15)6-3-4-7-13/h12,14H,3-11H2,1-2H3
InChIKeyOAEJSCHGUGLHLH-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds3

About 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane

10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane (PubChem CID 64942299) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane
PubChem CID64942299
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane
SMILESCOCC(C)N1CCCNC2(CCCC2)C1
InChIInChI=1S/C13H26N2O/c1-12(10-16-2)15-9-5-8-14-13(11-15)6-3-4-7-13/h12,14H,3-11H2,1-2H3
InChIKeyOAEJSCHGUGLHLH-UHFFFAOYSA-N
XLogP1.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane (CID 64942299) is 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane is COCC(C)N1CCCNC2(CCCC2)C1.
What is the InChIKey of 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane?
The InChIKey is OAEJSCHGUGLHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12(10-16-2)15-9-5-8-14-13(11-15)6-3-4-7-13/h12,14H,3-11H2,1-2H3.
What are the key properties of 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane?
10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane has a molecular weight of 226.36 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(1-methoxypropan-2-yl)-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 64942299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).