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

C11H17NOS — CID 131110771

IUPACcyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol
SMILESCc1cc(C(O)C2CCCCC2)sn1
InChIInChI=1S/C11H17NOS/c1-8-7-10(14-12-8)11(13)9-5-3-2-4-6-9/h7,9,11,13H,2-6H2,1H3
InChIKeyMACLILLUTVHBLB-UHFFFAOYSA-N
MW211.33 g/mol
LogP3.07
Rot. Bonds2

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

cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol (PubChem CID 131110771) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Namecyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol
PubChem CID131110771
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Namecyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol
SMILESCc1cc(C(O)C2CCCCC2)sn1
InChIInChI=1S/C11H17NOS/c1-8-7-10(14-12-8)11(13)9-5-3-2-4-6-9/h7,9,11,13H,2-6H2,1H3
InChIKeyMACLILLUTVHBLB-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol?
The IUPAC name of cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol (CID 131110771) is cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol.
What is the SMILES notation for cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol?
The canonical SMILES for cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol is Cc1cc(C(O)C2CCCCC2)sn1.
What is the InChIKey of cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol?
The InChIKey is MACLILLUTVHBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-8-7-10(14-12-8)11(13)9-5-3-2-4-6-9/h7,9,11,13H,2-6H2,1H3.
What are the key properties of cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol?
cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol has a molecular weight of 211.33 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(3-methyl-1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 131110771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).