(5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane

C11H18O2 — CID 163472987

IUPAC(5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane
SMILESCO[C@H]1CC2(CC2)O[C@@H](C)C12CC2
InChIInChI=1S/C11H18O2/c1-8-11(5-6-11)9(12-2)7-10(13-8)3-4-10/h8-9H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKeyBYCCWJWTYSIENH-IUCAKERBSA-N
MW182.26 g/mol
LogP2.12
Rot. Bonds1

About (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane

(5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane (PubChem CID 163472987) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane.

Molecular Properties

Compound Name(5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane
PubChem CID163472987
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name(5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane
SMILESCO[C@H]1CC2(CC2)O[C@@H](C)C12CC2
InChIInChI=1S/C11H18O2/c1-8-11(5-6-11)9(12-2)7-10(13-8)3-4-10/h8-9H,3-7H2,1-2H3/t8-,9-/m0/s1
InChIKeyBYCCWJWTYSIENH-IUCAKERBSA-N
XLogP2.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5R,7R)-5-methoxy-4-oxaspiro[2.5]octan-7-ol
CID 129387887
(5S,6S)-6-methoxy-4-oxadispiro[2.1.25.33]decane
CID 163836885
2-methoxy-1,1-dimethylcyclobutane
CID 58806257
2-methoxy-1,1,5-trimethylcyclohexane
CID 59938882
2-methoxy-1,1,4-trimethylcyclohexane
CID 70179049
4-methoxy-6-oxaspiro[2.5]octan-2-amine
CID 130927854
4-butyl-3-methoxy-5-methylbicyclo[2.2.2]octane-1-carbonitrile
CID 177152562
(1S,2S,5S,8S,9R)-2-methoxy-4,4,8-trimethyltricyclo[6.3.1.01,5]dodecan-9-ol
CID 44584079
(4aS,8aR)-2-methoxy-3,3,5,5,8a-pentamethyl-2,4,4a,6,7,8-hexahydrochromene
CID 14944769
(5R)-4-methoxy-7-methyl-6-oxa-1-azaspiro[4.5]decan-2-one
CID 149102499
3-methoxyspiro[3.4]octan-1-amine
CID 66357973
1,3-dimethoxy-7-azaspiro[3.5]nonane
CID 146150415

Frequently Asked Questions

What is the IUPAC name of (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane?
The IUPAC name of (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane (CID 163472987) is (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane.
What is the SMILES notation for (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane?
The canonical SMILES for (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane is CO[C@H]1CC2(CC2)O[C@@H](C)C12CC2.
What is the InChIKey of (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane?
The InChIKey is BYCCWJWTYSIENH-IUCAKERBSA-N. The full InChI is InChI=1S/C11H18O2/c1-8-11(5-6-11)9(12-2)7-10(13-8)3-4-10/h8-9H,3-7H2,1-2H3/t8-,9-/m0/s1.
What are the key properties of (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane?
(5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane has a molecular weight of 182.26 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,9S)-5-methoxy-9-methyl-10-oxadispiro[2.2.26.23]decane is sourced from PubChem (CID 163472987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).