1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol

C10H15NO2S — CID 126985714

IUPAC1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
SMILESOC(c1ccsn1)C1(O)CCCCC1
InChIInChI=1S/C10H15NO2S/c12-9(8-4-7-14-11-8)10(13)5-2-1-3-6-10/h4,7,9,12-13H,1-3,5-6H2
InChIKeyVFNLYCOPQZDSGG-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.87
Rot. Bonds2

About 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol

1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol (PubChem CID 126985714) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
PubChem CID126985714
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
SMILESOC(c1ccsn1)C1(O)CCCCC1
InChIInChI=1S/C10H15NO2S/c12-9(8-4-7-14-11-8)10(13)5-2-1-3-6-10/h4,7,9,12-13H,1-3,5-6H2
InChIKeyVFNLYCOPQZDSGG-UHFFFAOYSA-N
XLogP1.87
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Isothiazolylphenylmethanol
CID 129752610
4,4-Difluoro-1-(1,2-thiazol-3-yl)cyclohex-2-en-1-ol
CID 165492024
1-(1,2-Thiazol-3-yl)butan-1-ol
CID 130642506
(2,2,3,3-Tetramethylcyclopropyl)-(1,2-thiazol-3-yl)methanol
CID 126985705
2,2,3,3-Tetramethyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 126985711
1-[Hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
CID 126985713
3,3-Dimethyl-1-(1,2-thiazol-3-yl)butane-1,2-diol
CID 126985715
Thian-2-yl(1,2-thiazol-3-yl)methanol
CID 126985730
Cyclopropyl(1,2-thiazol-3-yl)methanol
CID 127002567
2-Methoxy-2-methyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 127002572
4-Methyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002594
2-Ethyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002598

Frequently Asked Questions

What is the IUPAC name of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol (CID 126985714) is 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol is OC(c1ccsn1)C1(O)CCCCC1.
What is the InChIKey of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol?
The InChIKey is VFNLYCOPQZDSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c12-9(8-4-7-14-11-8)10(13)5-2-1-3-6-10/h4,7,9,12-13H,1-3,5-6H2.
What are the key properties of 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol?
1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol has a molecular weight of 213.30 g/mol, XLogP of 1.87, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 126985714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).