4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole

C14H10FNS2 — CID 8963401

IUPAC4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole
SMILESCc1sc(-c2cccs2)nc1-c1ccc(F)cc1
InChIInChI=1S/C14H10FNS2/c1-9-13(10-4-6-11(15)7-5-10)16-14(18-9)12-3-2-8-17-12/h2-8H,1H3
InChIKeyYTVUVQLAPCZOEG-UHFFFAOYSA-N
MW275.37 g/mol
LogP4.99
Rot. Bonds2

About 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole

4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole (PubChem CID 8963401) has the molecular formula C14H10FNS2 and a molecular weight of 275.37 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole
PubChem CID8963401
Molecular FormulaC14H10FNS2
Molecular Weight275.37 g/mol
Exact Mass275.02
IUPAC Name4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole
SMILESCc1sc(-c2cccs2)nc1-c1ccc(F)cc1
InChIInChI=1S/C14H10FNS2/c1-9-13(10-4-6-11(15)7-5-10)16-14(18-9)12-3-2-8-17-12/h2-8H,1H3
InChIKeyYTVUVQLAPCZOEG-UHFFFAOYSA-N
XLogP4.99
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole?
The IUPAC name of 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole (CID 8963401) is 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole.
What is the SMILES notation for 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole?
The canonical SMILES for 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole is Cc1sc(-c2cccs2)nc1-c1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole?
The InChIKey is YTVUVQLAPCZOEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FNS2/c1-9-13(10-4-6-11(15)7-5-10)16-14(18-9)12-3-2-8-17-12/h2-8H,1H3.
What are the key properties of 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole?
4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole has a molecular weight of 275.37 g/mol, XLogP of 4.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-methyl-2-thiophen-2-yl-1,3-thiazole is sourced from PubChem (CID 8963401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).