(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol

C11H17NOS — CID 59295456

IUPAC(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol
SMILESCc1nc(C2CCCCC2)sc1CO
InChIInChI=1S/C11H17NOS/c1-8-10(7-13)14-11(12-8)9-5-3-2-4-6-9/h9,13H,2-7H2,1H3
InChIKeyXCPNSIKWMAGLDD-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.99
Rot. Bonds2

About (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol

(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol (PubChem CID 59295456) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol
PubChem CID59295456
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol
SMILESCc1nc(C2CCCCC2)sc1CO
InChIInChI=1S/C11H17NOS/c1-8-10(7-13)14-11(12-8)9-5-3-2-4-6-9/h9,13H,2-7H2,1H3
InChIKeyXCPNSIKWMAGLDD-UHFFFAOYSA-N
XLogP2.99
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol?
The IUPAC name of (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol (CID 59295456) is (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol.
What is the SMILES notation for (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol?
The canonical SMILES for (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol is Cc1nc(C2CCCCC2)sc1CO.
What is the InChIKey of (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol?
The InChIKey is XCPNSIKWMAGLDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-8-10(7-13)14-11(12-8)9-5-3-2-4-6-9/h9,13H,2-7H2,1H3.
What are the key properties of (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol?
(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol has a molecular weight of 211.33 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)methanol is sourced from PubChem (CID 59295456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).