ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane

C12H26N2O — CID 155741469

IUPACethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane
SMILESCC.CCN1CC2(CNCC(C)(C)O2)C1
InChIInChI=1S/C10H20N2O.C2H6/c1-4-12-7-10(8-12)6-11-5-9(2,3)13-10;1-2/h11H,4-8H2,1-3H3;1-2H3
InChIKeyXSWAPQRIHMXPEP-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds1

About ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane

ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane (PubChem CID 155741469) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane.

Molecular Properties

Compound Nameethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane
PubChem CID155741469
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Nameethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane
SMILESCC.CCN1CC2(CNCC(C)(C)O2)C1
InChIInChI=1S/C10H20N2O.C2H6/c1-4-12-7-10(8-12)6-11-5-9(2,3)13-10;1-2/h11H,4-8H2,1-3H3;1-2H3
InChIKeyXSWAPQRIHMXPEP-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 143725560
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1-ethyl-4-[(3-methylazetidin-3-yl)methyl]piperazine
CID 130854837
2-ethyl-5-fluoro-5-methyl-2,7-diazaspiro[3.5]nonane
CID 154671164
ethane;2-ethyl-5-fluoro-5-methyl-2,7-diazaspiro[3.5]nonane
CID 154671163
1-(4-ethyl-2,2-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)-2,2,2-trifluoroethanone
CID 88924194
ethane;1-ethyl-3,3-difluoro-4,4-dimethylpyrrolidine
CID 144847221
2-ethyl-5,5-difluoro-2,7-diazaspiro[3.5]nonane
CID 175631153
(3aR,6aS)-2-ethyl-3a,6a-dimethyl-5-propan-2-yl-1,3,4,6-tetrahydropyrrolo[3,4-c]pyrrole
CID 170578237
acetic acid;1-(2,2-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)-2,2,2-trifluoroethanone
CID 86672453
2-benzyl-2,6,6-trimethylmorpholine
CID 65126692

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?
The IUPAC name of ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane (CID 155741469) is ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane.
What is the SMILES notation for ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?
The canonical SMILES for ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane is CC.CCN1CC2(CNCC(C)(C)O2)C1.
What is the InChIKey of ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?
The InChIKey is XSWAPQRIHMXPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O.C2H6/c1-4-12-7-10(8-12)6-11-5-9(2,3)13-10;1-2/h11H,4-8H2,1-3H3;1-2H3.
What are the key properties of ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?
ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane has a molecular weight of 214.35 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 155741469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).