1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol

C11H14O2S — CID 117300712

IUPAC1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol
SMILESCOc1cccc(SC)c1C1(O)CC1
InChIInChI=1S/C11H14O2S/c1-13-8-4-3-5-9(14-2)10(8)11(12)6-7-11/h3-5,12H,6-7H2,1-2H3
InChIKeyYRKGACIIUBJXCY-UHFFFAOYSA-N
MW210.30 g/mol
LogP2.40
Rot. Bonds3

About 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol

1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol (PubChem CID 117300712) has the molecular formula C11H14O2S and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol
PubChem CID117300712
Molecular FormulaC11H14O2S
Molecular Weight210.30 g/mol
Exact Mass210.07
IUPAC Name1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol
SMILESCOc1cccc(SC)c1C1(O)CC1
InChIInChI=1S/C11H14O2S/c1-13-8-4-3-5-9(14-2)10(8)11(12)6-7-11/h3-5,12H,6-7H2,1-2H3
InChIKeyYRKGACIIUBJXCY-UHFFFAOYSA-N
XLogP2.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-amine
CID 117299512
1-(2-fluoro-6-methoxyphenyl)cyclopropan-1-ol
CID 65434652
1-(2-methoxy-6-methylsulfanylphenyl)cyclohexan-1-amine
CID 117382282
1-[2-(fluoromethyl)-6-methoxyphenyl]cyclopropan-1-ol
CID 117286177
2-(1-isocyanatocyclobutyl)-1-methoxy-3-methylsulfanylbenzene
CID 117376765
1-(2-fluoro-3-methoxyphenyl)cyclopropan-1-ol
CID 83808255
1-(3-fluoro-2,6-dimethoxyphenyl)cyclopropan-1-ol
CID 117302785
2-fluoro-1-methoxy-3-methylsulfanylbenzene
CID 91881055
1-(2,6-difluoro-3-methoxyphenyl)cyclopropan-1-ol
CID 84775707
methyl 2-hydroxy-2-(2-methoxy-6-methylsulfanylphenyl)acetate
CID 117357886
2-(2-methoxy-6-methylsulfanylphenyl)propan-1-ol
CID 117303266
1-(2-amino-3-methoxyphenyl)cyclopentan-1-ol
CID 117104185

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol (CID 117300712) is 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol is COc1cccc(SC)c1C1(O)CC1.
What is the InChIKey of 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol?
The InChIKey is YRKGACIIUBJXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2S/c1-13-8-4-3-5-9(14-2)10(8)11(12)6-7-11/h3-5,12H,6-7H2,1-2H3.
What are the key properties of 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol?
1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol has a molecular weight of 210.30 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-6-methylsulfanylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 117300712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).