2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide

C17H13FN2O2S — CID 4626253

IUPAC2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide
SMILESO=C(Nc1nc(COc2ccccc2)cs1)c1ccccc1F
InChIInChI=1S/C17H13FN2O2S/c18-15-9-5-4-8-14(15)16(21)20-17-19-12(11-23-17)10-22-13-6-2-1-3-7-13/h1-9,11H,10H2,(H,19,20,21)
InChIKeyQFIZWLHOOMPEPD-UHFFFAOYSA-N
MW328.37 g/mol
LogP4.11
Rot. Bonds5

About 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide

2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide (PubChem CID 4626253) has the molecular formula C17H13FN2O2S and a molecular weight of 328.37 g/mol. Its IUPAC name is 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide
PubChem CID4626253
Molecular FormulaC17H13FN2O2S
Molecular Weight328.37 g/mol
Exact Mass328.07
IUPAC Name2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide
SMILESO=C(Nc1nc(COc2ccccc2)cs1)c1ccccc1F
InChIInChI=1S/C17H13FN2O2S/c18-15-9-5-4-8-14(15)16(21)20-17-19-12(11-23-17)10-22-13-6-2-1-3-7-13/h1-9,11H,10H2,(H,19,20,21)
InChIKeyQFIZWLHOOMPEPD-UHFFFAOYSA-N
XLogP4.11
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-(4-methylthiazol-2-yl)benzamide
CID 2679292
4-Methoxy-N-(4-phenyl-2-thiazolyl)benzamide
CID 668712
Ethyl 2-[(4-ethoxybenzoyl)amino]-1,3-thiazole-4-carboxylate
CID 2381436
2-(4-fluorophenyl)-N-[4-(5-methylfuran-2-yl)-1,3-thiazol-2-yl]acetamide
CID 2464348
N-(4-methyl-1,3-thiazol-2-yl)-4-(oxolan-2-ylmethoxy)benzamide
CID 4879505
N-(4-(4-methoxyphenyl)thiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide
CID 3397982
N-(4-Methyl-1,3-thiazol-2-yl)-3-phenoxybenzamide
CID 2092675
2-amino-5-(4-fluorophenoxy)-N-(4-methylthiazol-2-yl)benzamide
CID 23067440
4-[(2-chlorophenoxy)methyl]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 145489062
4-oxo-N-(4-phenylthiazol-2-yl)-4H-chromene-2-carboxamide
CID 746084
N-[4-(2,5-Dimethoxy-phenyl)-thiazol-2-yl]-2-fluoro-benzamide
CID 1160658
3-Furan-2-yl-N-(4-phenyl-thiazol-2-yl)-acrylamide
CID 1585136

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide?
The IUPAC name of 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide (CID 4626253) is 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide.
What is the SMILES notation for 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide?
The canonical SMILES for 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide is O=C(Nc1nc(COc2ccccc2)cs1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide?
The InChIKey is QFIZWLHOOMPEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O2S/c18-15-9-5-4-8-14(15)16(21)20-17-19-12(11-23-17)10-22-13-6-2-1-3-7-13/h1-9,11H,10H2,(H,19,20,21).
What are the key properties of 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide?
2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide has a molecular weight of 328.37 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]benzamide is sourced from PubChem (CID 4626253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).