ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane

C11H24N2O — CID 153344287

IUPACethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
SMILESCC.CC1COC2(CCNCC2)CN1
InChIInChI=1S/C9H18N2O.C2H6/c1-8-6-12-9(7-11-8)2-4-10-5-3-9;1-2/h8,10-11H,2-7H2,1H3;1-2H3
InChIKeyJNGYZOGEIBBWJI-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.14
Rot. Bonds

About ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane

ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane (PubChem CID 153344287) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Nameethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
PubChem CID153344287
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Nameethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
SMILESCC.CC1COC2(CCNCC2)CN1
InChIInChI=1S/C9H18N2O.C2H6/c1-8-6-12-9(7-11-8)2-4-10-5-3-9;1-2/h8,10-11H,2-7H2,1H3;1-2H3
InChIKeyJNGYZOGEIBBWJI-UHFFFAOYSA-N
XLogP1.14
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The IUPAC name of ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane (CID 153344287) is ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane.
What is the SMILES notation for ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The canonical SMILES for ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane is CC.CC1COC2(CCNCC2)CN1.
What is the InChIKey of ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The InChIKey is JNGYZOGEIBBWJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O.C2H6/c1-8-6-12-9(7-11-8)2-4-10-5-3-9;1-2/h8,10-11H,2-7H2,1H3;1-2H3.
What are the key properties of ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane has a molecular weight of 200.33 g/mol, XLogP of 1.14, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-1-oxa-4,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 153344287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).