ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane

C12H25NO — CID 153356983

IUPACethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane
SMILESCC.CCN1CCCCC12CCOC2
InChIInChI=1S/C10H19NO.C2H6/c1-2-11-7-4-3-5-10(11)6-8-12-9-10;1-2/h2-9H2,1H3;1-2H3
InChIKeyOBKDGCDPSMLQCE-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.68
Rot. Bonds1

About ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane

ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane (PubChem CID 153356983) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane.

Molecular Properties

Compound Nameethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane
PubChem CID153356983
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Nameethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane
SMILESCC.CCN1CCCCC12CCOC2
InChIInChI=1S/C10H19NO.C2H6/c1-2-11-7-4-3-5-10(11)6-8-12-9-10;1-2/h2-9H2,1H3;1-2H3
InChIKeyOBKDGCDPSMLQCE-UHFFFAOYSA-N
XLogP2.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-8-oxa-1-azaspiro[5.5]undecane
CID 166896589
1-(7-oxa-1-azaspiro[4.4]nonan-1-yl)propan-2-ol
CID 130627672
(5R)-6-propan-2-yl-2-oxa-6-azaspiro[4.5]decane
CID 170024825
2-oxa-5-azaspiro[3.5]nonan-5-ylmethanethiol
CID 170083694
6-tert-butyl-2-oxa-6-azaspiro[4.5]decane
CID 162462248
3-(7-oxa-1-azaspiro[4.4]nonan-1-yl)propanal
CID 130727536
cyclopentyl-(1-ethyl-4-oxa-1,9-diazaspiro[5.5]undecan-9-yl)methanone
CID 97491865
(2R)-1-amino-3-(7-oxa-1-azaspiro[4.4]nonan-1-yl)propan-2-ol
CID 126997898
(6S,11S)-1,11-diethyl-8-oxa-1-azaspiro[5.5]undecane
CID 122597278
(5R)-1-propan-2-yl-7-oxa-1-azaspiro[4.4]nonane
CID 177187241
1-tert-butyl-7-oxa-1-azaspiro[4.4]nonane
CID 130211344
5-(2,2-diethoxyethyl)-8-oxa-5-azaspiro[3.5]nonane
CID 75507361

Frequently Asked Questions

What is the IUPAC name of ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane?
The IUPAC name of ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane (CID 153356983) is ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane.
What is the SMILES notation for ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane?
The canonical SMILES for ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane is CC.CCN1CCCCC12CCOC2.
What is the InChIKey of ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane?
The InChIKey is OBKDGCDPSMLQCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.C2H6/c1-2-11-7-4-3-5-10(11)6-8-12-9-10;1-2/h2-9H2,1H3;1-2H3.
What are the key properties of ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane?
ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane has a molecular weight of 199.34 g/mol, XLogP of 2.68, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-ethyl-2-oxa-6-azaspiro[4.5]decane is sourced from PubChem (CID 153356983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).