2-cyclohexyl-5-fluoro-1,3-thiazole

C9H12FNS — CID 155693578

IUPAC2-cyclohexyl-5-fluoro-1,3-thiazole
SMILESFc1cnc(C2CCCCC2)s1
InChIInChI=1S/C9H12FNS/c10-8-6-11-9(12-8)7-4-2-1-3-5-7/h6-7H,1-5H2
InChIKeySPOZOPYLUJZGEM-UHFFFAOYSA-N
MW185.27 g/mol
LogP3.33
Rot. Bonds1

About 2-cyclohexyl-5-fluoro-1,3-thiazole

2-cyclohexyl-5-fluoro-1,3-thiazole (PubChem CID 155693578) has the molecular formula C9H12FNS and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-cyclohexyl-5-fluoro-1,3-thiazole.

Molecular Properties

Compound Name2-cyclohexyl-5-fluoro-1,3-thiazole
PubChem CID155693578
Molecular FormulaC9H12FNS
Molecular Weight185.27 g/mol
Exact Mass185.07
IUPAC Name2-cyclohexyl-5-fluoro-1,3-thiazole
SMILESFc1cnc(C2CCCCC2)s1
InChIInChI=1S/C9H12FNS/c10-8-6-11-9(12-8)7-4-2-1-3-5-7/h6-7H,1-5H2
InChIKeySPOZOPYLUJZGEM-UHFFFAOYSA-N
XLogP3.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-fluoro-1,3-thiazole?
The IUPAC name of 2-cyclohexyl-5-fluoro-1,3-thiazole (CID 155693578) is 2-cyclohexyl-5-fluoro-1,3-thiazole.
What is the SMILES notation for 2-cyclohexyl-5-fluoro-1,3-thiazole?
The canonical SMILES for 2-cyclohexyl-5-fluoro-1,3-thiazole is Fc1cnc(C2CCCCC2)s1.
What is the InChIKey of 2-cyclohexyl-5-fluoro-1,3-thiazole?
The InChIKey is SPOZOPYLUJZGEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FNS/c10-8-6-11-9(12-8)7-4-2-1-3-5-7/h6-7H,1-5H2.
What are the key properties of 2-cyclohexyl-5-fluoro-1,3-thiazole?
2-cyclohexyl-5-fluoro-1,3-thiazole has a molecular weight of 185.27 g/mol, XLogP of 3.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-fluoro-1,3-thiazole is sourced from PubChem (CID 155693578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).