ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane

C11H23NO — CID 162765385

IUPACethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane
SMILESCC.CCC1CC2(CCNCC2)O1
InChIInChI=1S/C9H17NO.C2H6/c1-2-8-7-9(11-8)3-5-10-6-4-9;1-2/h8,10H,2-7H2,1H3;1-2H3
InChIKeyHLIPGBJRTBHDEZ-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.33
Rot. Bonds1

About ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane

ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane (PubChem CID 162765385) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Nameethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane
PubChem CID162765385
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Nameethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane
SMILESCC.CCC1CC2(CCNCC2)O1
InChIInChI=1S/C9H17NO.C2H6/c1-2-8-7-9(11-8)3-5-10-6-4-9;1-2/h8,10H,2-7H2,1H3;1-2H3
InChIKeyHLIPGBJRTBHDEZ-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(1-oxa-7-azaspiro[3.5]nonan-2-ylmethyl)benzenesulfonamide
CID 155861594
6-azaspiro[2.5]octane;ethane;propane
CID 176979994
1-oxa-7-azaspiro[4.4]nonan-2-ylmethanol
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4-ethyl-11-methyl-3-oxa-9-azaspiro[5.5]undecane
CID 79321378
3-methyl-1-oxa-8-azaspiro[4.5]decane;2-methylpropane
CID 144742113
3-tert-butyl-1-oxa-8-azaspiro[4.5]decane
CID 171431706
(5S,7S)-7-ethyl-2,6-dioxa-9-azaspiro[4.5]decane
CID 96936612
(5S,7R)-7-ethyl-2,6-dioxa-9-azaspiro[4.5]decane
CID 96936611
1-oxa-8-azaspiro[4.5]decan-2-ol
CID 150619629
3-fluoro-1-oxa-8-azaspiro[4.5]decane
CID 55280856

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane?
The IUPAC name of ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane (CID 162765385) is ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane.
What is the SMILES notation for ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane?
The canonical SMILES for ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane is CC.CCC1CC2(CCNCC2)O1.
What is the InChIKey of ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane?
The InChIKey is HLIPGBJRTBHDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.C2H6/c1-2-8-7-9(11-8)3-5-10-6-4-9;1-2/h8,10H,2-7H2,1H3;1-2H3.
What are the key properties of ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane?
ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane has a molecular weight of 185.31 g/mol, XLogP of 2.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-1-oxa-7-azaspiro[3.5]nonane is sourced from PubChem (CID 162765385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).