4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole

C10H8FNOS — CID 4984858

IUPAC4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole
SMILESCOc1ccc(F)cc1-c1cscn1
InChIInChI=1S/C10H8FNOS/c1-13-10-3-2-7(11)4-8(10)9-5-14-6-12-9/h2-6H,1H3
InChIKeyCDNDTAMNQHUENN-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.96
Rot. Bonds2

About 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole

4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole (PubChem CID 4984858) has the molecular formula C10H8FNOS and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole
PubChem CID4984858
Molecular FormulaC10H8FNOS
Molecular Weight209.25 g/mol
Exact Mass209.03
IUPAC Name4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole
SMILESCOc1ccc(F)cc1-c1cscn1
InChIInChI=1S/C10H8FNOS/c1-13-10-3-2-7(11)4-8(10)9-5-14-6-12-9/h2-6H,1H3
InChIKeyCDNDTAMNQHUENN-UHFFFAOYSA-N
XLogP2.96
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole?
The IUPAC name of 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole (CID 4984858) is 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole.
What is the SMILES notation for 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole?
The canonical SMILES for 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole is COc1ccc(F)cc1-c1cscn1.
What is the InChIKey of 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole?
The InChIKey is CDNDTAMNQHUENN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNOS/c1-13-10-3-2-7(11)4-8(10)9-5-14-6-12-9/h2-6H,1H3.
What are the key properties of 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole?
4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole has a molecular weight of 209.25 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-methoxyphenyl)-1,3-thiazole is sourced from PubChem (CID 4984858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).