5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole

C11H10FNS — CID 154266001

IUPAC5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole
SMILESCc1ncsc1Cc1ccccc1F
InChIInChI=1S/C11H10FNS/c1-8-11(14-7-13-8)6-9-4-2-3-5-10(9)12/h2-5,7H,6H2,1H3
InChIKeyYSCLFPZSHZAJIM-UHFFFAOYSA-N
MW207.27 g/mol
LogP3.18
Rot. Bonds2

About 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole

5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole (PubChem CID 154266001) has the molecular formula C11H10FNS and a molecular weight of 207.27 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole
PubChem CID154266001
Molecular FormulaC11H10FNS
Molecular Weight207.27 g/mol
Exact Mass207.05
IUPAC Name5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole
SMILESCc1ncsc1Cc1ccccc1F
InChIInChI=1S/C11H10FNS/c1-8-11(14-7-13-8)6-9-4-2-3-5-10(9)12/h2-5,7H,6H2,1H3
InChIKeyYSCLFPZSHZAJIM-UHFFFAOYSA-N
XLogP3.18
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole?
The IUPAC name of 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole (CID 154266001) is 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole?
The canonical SMILES for 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole is Cc1ncsc1Cc1ccccc1F.
What is the InChIKey of 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole?
The InChIKey is YSCLFPZSHZAJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNS/c1-8-11(14-7-13-8)6-9-4-2-3-5-10(9)12/h2-5,7H,6H2,1H3.
What are the key properties of 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole?
5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole has a molecular weight of 207.27 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazole is sourced from PubChem (CID 154266001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).