2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol

C8H16OS — CID 143890970

IUPAC2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol
SMILESCSC1CCC(O)C1(C)C
InChIInChI=1S/C8H16OS/c1-8(2)6(9)4-5-7(8)10-3/h6-7,9H,4-5H2,1-3H3
InChIKeyPFEOTVDUDVZGGS-UHFFFAOYSA-N
MW160.28 g/mol
LogP1.90
Rot. Bonds1

About 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol

2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol (PubChem CID 143890970) has the molecular formula C8H16OS and a molecular weight of 160.28 g/mol. Its IUPAC name is 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol
PubChem CID143890970
Molecular FormulaC8H16OS
Molecular Weight160.28 g/mol
Exact Mass160.09
IUPAC Name2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol
SMILESCSC1CCC(O)C1(C)C
InChIInChI=1S/C8H16OS/c1-8(2)6(9)4-5-7(8)10-3/h6-7,9H,4-5H2,1-3H3
InChIKeyPFEOTVDUDVZGGS-UHFFFAOYSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.28
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,3-trimethylcyclopentan-1-ol;2,2,3-trimethylcyclopentan-1-one
CID 157414716
2-methylsulfanylcyclopropan-1-ol
CID 54469383
2,2-dimethylpyrrolidin-3-ol
CID 71669042
(2R)-1,1-difluoro-2-methylsulfanylcyclopropane
CID 174288663
(2R)-1-methylcyclobutane-1,2-diol
CID 130694777
1,1-dimethyl-3,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydro-2H-phenanthren-2-ol
CID 118905117
2,2-dimethyl-3-[(3-methylsulfanylcyclohexyl)amino]cyclobutan-1-ol
CID 103952052
8,8,9-trimethylspiro[3.5]nonan-7-ol
CID 123702304
3-ethyl-2,2,4,4-tetramethylcyclohexan-1-ol
CID 142000591
(1R,3aR,5S,7aS)-1,4,4,7a-tetramethyl-2,3,3a,5,6,7-hexahydroindene-1,5-diol
CID 10703779
4-ethyl-2,2,3,4-tetramethylcyclohexan-1-ol
CID 123306354
4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-1,4a-diol
CID 162816105

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol?
The IUPAC name of 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol (CID 143890970) is 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol is CSC1CCC(O)C1(C)C.
What is the InChIKey of 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol?
The InChIKey is PFEOTVDUDVZGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16OS/c1-8(2)6(9)4-5-7(8)10-3/h6-7,9H,4-5H2,1-3H3.
What are the key properties of 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol?
2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol has a molecular weight of 160.28 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-methylsulfanylcyclopentan-1-ol is sourced from PubChem (CID 143890970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).