(2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane

C11H21NO — CID 138970009

IUPAC(2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane
SMILESCC[C@@]1(C)NC2(CCCCC2)CO1
InChIInChI=1S/C11H21NO/c1-3-10(2)12-11(9-13-10)7-5-4-6-8-11/h12H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyLHRXRBTWUGKEMV-JTQLQIEISA-N
MW183.29 g/mol
LogP2.44
Rot. Bonds1

About (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane

(2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane (PubChem CID 138970009) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane.

Molecular Properties

Compound Name(2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane
PubChem CID138970009
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane
SMILESCC[C@@]1(C)NC2(CCCCC2)CO1
InChIInChI=1S/C11H21NO/c1-3-10(2)12-11(9-13-10)7-5-4-6-8-11/h12H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyLHRXRBTWUGKEMV-JTQLQIEISA-N
XLogP2.44
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

16-oxa-8-azadispiro[5.2.59.26]hexadecane
CID 65213480
2-ethyl-2-methyl-1,3-oxazinane
CID 535787
1-azaspiro[2.6]nonane;propane
CID 171101466
3-methyl-3-propan-2-yl-4-oxa-1-azaspiro[5.5]undecane
CID 114494533
3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64883094
2,4,4-trimethyl-2-propyl-1,3-oxazolidine
CID 117228404
2,2,7,7-tetraethylazepane
CID 141391729
1,1-dimethylcyclopropane;2,2-dimethyloxirane;1-ethyl-1-methylcyclopropane;2-ethyl-2-methyloxirane
CID 158162531
2,3-diethyl-2,3-dimethylazepane
CID 143907856
(3-methyl-1-oxa-4-azaspiro[4.5]decan-3-yl)methanol;hydrochloride
CID 3071183
1-ethyl-1-methylcyclohexane;molecular hydrogen
CID 143091347
2,2-dimethyl-1-azaspiro[4.4]nonane
CID 54027373

Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane?
The IUPAC name of (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane (CID 138970009) is (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane.
What is the SMILES notation for (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane?
The canonical SMILES for (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane is CC[C@@]1(C)NC2(CCCCC2)CO1.
What is the InChIKey of (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane?
The InChIKey is LHRXRBTWUGKEMV-JTQLQIEISA-N. The full InChI is InChI=1S/C11H21NO/c1-3-10(2)12-11(9-13-10)7-5-4-6-8-11/h12H,3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane?
(2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane has a molecular weight of 183.29 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethyl-2-methyl-3-oxa-1-azaspiro[4.5]decane is sourced from PubChem (CID 138970009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).