4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide

C10H7FN2OS — CID 19375910

IUPAC4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide
SMILESNC(=O)c1nc(-c2cccc(F)c2)cs1
InChIInChI=1S/C10H7FN2OS/c11-7-3-1-2-6(4-7)8-5-15-10(13-8)9(12)14/h1-5H,(H2,12,14)
InChIKeyLDPHNLXGUPHKFA-UHFFFAOYSA-N
MW222.24 g/mol
LogP2.05
Rot. Bonds2

About 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide

4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide (PubChem CID 19375910) has the molecular formula C10H7FN2OS and a molecular weight of 222.24 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide
PubChem CID19375910
Molecular FormulaC10H7FN2OS
Molecular Weight222.24 g/mol
Exact Mass222.03
IUPAC Name4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide
SMILESNC(=O)c1nc(-c2cccc(F)c2)cs1
InChIInChI=1S/C10H7FN2OS/c11-7-3-1-2-6(4-7)8-5-15-10(13-8)9(12)14/h1-5H,(H2,12,14)
InChIKeyLDPHNLXGUPHKFA-UHFFFAOYSA-N
XLogP2.05
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-4-phenyl-1,3-thiazole
CID 584377
N-ethyl-2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide
CID 2591198
2-Phenyl-1,3-thiazole-4-carbohydrazide
CID 2740635
1-(2-Phenyl-1,3-thiazol-4-yl)ethan-1-one
CID 604819
2-(4-p-Tolyl-thiazol-2-yl)-acetamide
CID 1079159
2-[3-(Trifluoromethyl)phenyl]-1,3-thiazole-4-carbohydrazide
CID 1478836
2-{[(4-Phenyl-1,3-thiazol-2-yl)methyl]thio}ethanohydrazide
CID 2821259
2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-N'-hydroxyethanimidamide
CID 9583366
2-(4-Phenyl-1,3-thiazol-2-yl)ethanethioamide
CID 724012
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 3244200
2-(4-Phenyl-1,3-thiazol-2-yl)acetamide
CID 712446
4-(4-Fluorophenyl)-2-thiazoleacetamide
CID 737186

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide?
The IUPAC name of 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide (CID 19375910) is 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide?
The canonical SMILES for 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide is NC(=O)c1nc(-c2cccc(F)c2)cs1.
What is the InChIKey of 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide?
The InChIKey is LDPHNLXGUPHKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2OS/c11-7-3-1-2-6(4-7)8-5-15-10(13-8)9(12)14/h1-5H,(H2,12,14).
What are the key properties of 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide?
4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide has a molecular weight of 222.24 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 19375910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).