1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol

C12H19NOS — CID 62653204

IUPAC1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol
SMILESCC1CCCC(c2ncc(C(C)O)s2)C1
InChIInChI=1S/C12H19NOS/c1-8-4-3-5-10(6-8)12-13-7-11(15-12)9(2)14/h7-10,14H,3-6H2,1-2H3
InChIKeyRDUDQVFDODJGCT-UHFFFAOYSA-N
MW225.36 g/mol
LogP3.49
Rot. Bonds2

About 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol

1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol (PubChem CID 62653204) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol
PubChem CID62653204
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol
SMILESCC1CCCC(c2ncc(C(C)O)s2)C1
InChIInChI=1S/C12H19NOS/c1-8-4-3-5-10(6-8)12-13-7-11(15-12)9(2)14/h7-10,14H,3-6H2,1-2H3
InChIKeyRDUDQVFDODJGCT-UHFFFAOYSA-N
XLogP3.49
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-piperidin-4-yl-1,3-thiazol-5-yl)ethanol
CID 115089882
1-[2-(1-propan-2-ylpiperidin-3-yl)-1,3-thiazol-5-yl]ethanol
CID 115090336
1-[2-(1,1-dioxothian-3-yl)-1,3-thiazol-5-yl]ethanol
CID 115090326
1-[2-(thiolan-3-yl)-1,3-thiazol-5-yl]ethanol
CID 115089750
(1R)-1-[2-(1,3-dioxolan-2-yl)-1,3-thiazol-5-yl]ethanol
CID 98041177
1-(2-cycloheptyl-1,3-thiazol-5-yl)-N-methylethanamine
CID 65399762
1-[2-(1-propan-2-ylpiperidin-2-yl)-1,3-thiazol-5-yl]ethanol
CID 115090612
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol
CID 63250668
1-[2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]ethanamine
CID 112681621
1-[2-(thian-4-yl)-1,3-thiazol-5-yl]ethanamine
CID 115089939
1-(2-cyclohexyl-1,3-thiazol-5-yl)propan-2-ol
CID 115091994
1-[2-(1,1-dioxothian-3-yl)-1,3-thiazol-5-yl]ethanamine
CID 115090388

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol?
The IUPAC name of 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol (CID 62653204) is 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol is CC1CCCC(c2ncc(C(C)O)s2)C1.
What is the InChIKey of 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol?
The InChIKey is RDUDQVFDODJGCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-8-4-3-5-10(6-8)12-13-7-11(15-12)9(2)14/h7-10,14H,3-6H2,1-2H3.
What are the key properties of 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol?
1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol has a molecular weight of 225.36 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methylcyclohexyl)-1,3-thiazol-5-yl]ethanol is sourced from PubChem (CID 62653204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).