2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one

C10H17NO2 — CID 10176401

IUPAC2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one
SMILESCC1OC2(CCN(C)CC2)CC1=O
InChIInChI=1S/C10H17NO2/c1-8-9(12)7-10(13-8)3-5-11(2)6-4-10/h8H,3-7H2,1-2H3
InChIKeyOODDNJQTVFMGCF-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.83
Rot. Bonds

About 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one

2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one (PubChem CID 10176401) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one
PubChem CID10176401
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one
SMILESCC1OC2(CCN(C)CC2)CC1=O
InChIInChI=1S/C10H17NO2/c1-8-9(12)7-10(13-8)3-5-11(2)6-4-10/h8H,3-7H2,1-2H3
InChIKeyOODDNJQTVFMGCF-UHFFFAOYSA-N
XLogP0.83
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Ethyl-8-methyl-3-oxo-1-oxa-8-azaspiro(4,5)decane
CID 125522
8-Methyl-1-oxa-8-azaspiro[4.5]decan-3-one
CID 10352099
2-Methyl-1-oxa-8-azaspiro[4.5]decan-4-one;hydrochloride
CID 23356732
2-Methyl-1-oxa-8-azaspiro[4.5]decan-3-one
CID 10241214
2,8,8-Trimethyl-1-oxa-8-azoniaspiro[4.5]decan-3-one iodide
CID 10448962
2,8-Dimethyl-1-oxa-8-azaspiro[4.5]decan-4-one
CID 10330010
(2S)-2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one
CID 10012596
tert-Butyl 3-oxo-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 45158734
Ethyl 2-methyl-3-oxo-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 4588469
Ethyl 2-oxo-4-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 10082452
(2R)-2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one
CID 10397468
1-[(3S)-2,3,8-trimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl]ethanone
CID 395101

Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one?
The IUPAC name of 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one (CID 10176401) is 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one.
What is the SMILES notation for 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one?
The canonical SMILES for 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one is CC1OC2(CCN(C)CC2)CC1=O.
What is the InChIKey of 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one?
The InChIKey is OODDNJQTVFMGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-8-9(12)7-10(13-8)3-5-11(2)6-4-10/h8H,3-7H2,1-2H3.
What are the key properties of 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one?
2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one has a molecular weight of 183.25 g/mol, XLogP of 0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-one is sourced from PubChem (CID 10176401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).