ethane;2-oxa-4,8-diazaspiro[5.5]undecane

C10H22N2O — CID 168995397

IUPACethane;2-oxa-4,8-diazaspiro[5.5]undecane
SMILESC1CNCC2(C1)CNCOC2.CC
InChIInChI=1S/C8H16N2O.C2H6/c1-2-8(4-9-3-1)5-10-7-11-6-8;1-2/h9-10H,1-7H2;1-2H3
InChIKeyYWYLOOBWVXHTRM-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.96
Rot. Bonds

About ethane;2-oxa-4,8-diazaspiro[5.5]undecane

ethane;2-oxa-4,8-diazaspiro[5.5]undecane (PubChem CID 168995397) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is ethane;2-oxa-4,8-diazaspiro[5.5]undecane.

Molecular Properties

Compound Nameethane;2-oxa-4,8-diazaspiro[5.5]undecane
PubChem CID168995397
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Nameethane;2-oxa-4,8-diazaspiro[5.5]undecane
SMILESC1CNCC2(C1)CNCOC2.CC
InChIInChI=1S/C8H16N2O.C2H6/c1-2-8(4-9-3-1)5-10-7-11-6-8;1-2/h9-10H,1-7H2;1-2H3
InChIKeyYWYLOOBWVXHTRM-UHFFFAOYSA-N
XLogP0.96
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;2-oxa-4,8-diazaspiro[5.5]undecane?
The IUPAC name of ethane;2-oxa-4,8-diazaspiro[5.5]undecane (CID 168995397) is ethane;2-oxa-4,8-diazaspiro[5.5]undecane.
What is the SMILES notation for ethane;2-oxa-4,8-diazaspiro[5.5]undecane?
The canonical SMILES for ethane;2-oxa-4,8-diazaspiro[5.5]undecane is C1CNCC2(C1)CNCOC2.CC.
What is the InChIKey of ethane;2-oxa-4,8-diazaspiro[5.5]undecane?
The InChIKey is YWYLOOBWVXHTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.C2H6/c1-2-8(4-9-3-1)5-10-7-11-6-8;1-2/h9-10H,1-7H2;1-2H3.
What are the key properties of ethane;2-oxa-4,8-diazaspiro[5.5]undecane?
ethane;2-oxa-4,8-diazaspiro[5.5]undecane has a molecular weight of 186.30 g/mol, XLogP of 0.96, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-oxa-4,8-diazaspiro[5.5]undecane is sourced from PubChem (CID 168995397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).