10-ethyl-1-oxaspiro[5.5]undecane

C12H22O — CID 144986649

IUPAC10-ethyl-1-oxaspiro[5.5]undecane
SMILESCCC1CCCC2(CCCCO2)C1
InChIInChI=1S/C12H22O/c1-2-11-6-5-8-12(10-11)7-3-4-9-13-12/h11H,2-10H2,1H3
InChIKeyNJJDWQHEOPMJFM-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.53
Rot. Bonds1

About 10-ethyl-1-oxaspiro[5.5]undecane

10-ethyl-1-oxaspiro[5.5]undecane (PubChem CID 144986649) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is 10-ethyl-1-oxaspiro[5.5]undecane.

Molecular Properties

Compound Name10-ethyl-1-oxaspiro[5.5]undecane
PubChem CID144986649
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name10-ethyl-1-oxaspiro[5.5]undecane
SMILESCCC1CCCC2(CCCCO2)C1
InChIInChI=1S/C12H22O/c1-2-11-6-5-8-12(10-11)7-3-4-9-13-12/h11H,2-10H2,1H3
InChIKeyNJJDWQHEOPMJFM-UHFFFAOYSA-N
XLogP3.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-ethyl-1-oxaspiro[4.5]decane
CID 137449478
(4R,6S)-4-ethyl-7-oxaspiro[5.6]dodec-9-ene
CID 125455009
3-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79913050
3-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexane-1-carboxylic acid
CID 79923331
9-ethyl-1-oxa-4-azaspiro[5.6]dodecane
CID 65122613
1-(1-oxaspiro[5.5]undecan-4-yl)propan-2-one
CID 79894719
N-(6-oxaspiro[4.5]decan-9-ylmethyl)ethanamine
CID 79914759
[(5S,8R)-1-oxaspiro[4.4]nonan-8-yl]methanamine
CID 99996112
6-ethyl-4-oxaspiro[2.4]heptane
CID 166857382
7-ethyl-1-oxa-3-azaspiro[4.5]decan-2-one
CID 45092419
9-chloro-3-ethyl-6-oxaspiro[4.5]decane
CID 64515030
11-ethyl-7-oxa-16-azadispiro[5.1.68.36]heptadecane
CID 65213736

Frequently Asked Questions

What is the IUPAC name of 10-ethyl-1-oxaspiro[5.5]undecane?
The IUPAC name of 10-ethyl-1-oxaspiro[5.5]undecane (CID 144986649) is 10-ethyl-1-oxaspiro[5.5]undecane.
What is the SMILES notation for 10-ethyl-1-oxaspiro[5.5]undecane?
The canonical SMILES for 10-ethyl-1-oxaspiro[5.5]undecane is CCC1CCCC2(CCCCO2)C1.
What is the InChIKey of 10-ethyl-1-oxaspiro[5.5]undecane?
The InChIKey is NJJDWQHEOPMJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O/c1-2-11-6-5-8-12(10-11)7-3-4-9-13-12/h11H,2-10H2,1H3.
What are the key properties of 10-ethyl-1-oxaspiro[5.5]undecane?
10-ethyl-1-oxaspiro[5.5]undecane has a molecular weight of 182.31 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethyl-1-oxaspiro[5.5]undecane is sourced from PubChem (CID 144986649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).