5-(3-fluorophenyl)-4-methyl-1,3-thiazole

C10H8FNS — CID 70235938

IUPAC5-(3-fluorophenyl)-4-methyl-1,3-thiazole
SMILESCc1ncsc1-c1cccc(F)c1
InChIInChI=1S/C10H8FNS/c1-7-10(13-6-12-7)8-3-2-4-9(11)5-8/h2-6H,1H3
InChIKeyVCSZCNJLMHOTRX-UHFFFAOYSA-N
MW193.25 g/mol
LogP3.26
Rot. Bonds1

About 5-(3-fluorophenyl)-4-methyl-1,3-thiazole

5-(3-fluorophenyl)-4-methyl-1,3-thiazole (PubChem CID 70235938) has the molecular formula C10H8FNS and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-(3-fluorophenyl)-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-(3-fluorophenyl)-4-methyl-1,3-thiazole
PubChem CID70235938
Molecular FormulaC10H8FNS
Molecular Weight193.25 g/mol
Exact Mass193.04
IUPAC Name5-(3-fluorophenyl)-4-methyl-1,3-thiazole
SMILESCc1ncsc1-c1cccc(F)c1
InChIInChI=1S/C10H8FNS/c1-7-10(13-6-12-7)8-3-2-4-9(11)5-8/h2-6H,1H3
InChIKeyVCSZCNJLMHOTRX-UHFFFAOYSA-N
XLogP3.26
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluorophenyl)-4-methyl-1,3-thiazole?
The IUPAC name of 5-(3-fluorophenyl)-4-methyl-1,3-thiazole (CID 70235938) is 5-(3-fluorophenyl)-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-(3-fluorophenyl)-4-methyl-1,3-thiazole?
The canonical SMILES for 5-(3-fluorophenyl)-4-methyl-1,3-thiazole is Cc1ncsc1-c1cccc(F)c1.
What is the InChIKey of 5-(3-fluorophenyl)-4-methyl-1,3-thiazole?
The InChIKey is VCSZCNJLMHOTRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNS/c1-7-10(13-6-12-7)8-3-2-4-9(11)5-8/h2-6H,1H3.
What are the key properties of 5-(3-fluorophenyl)-4-methyl-1,3-thiazole?
5-(3-fluorophenyl)-4-methyl-1,3-thiazole has a molecular weight of 193.25 g/mol, XLogP of 3.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)-4-methyl-1,3-thiazole is sourced from PubChem (CID 70235938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).