N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide

C16H14FN3O4S2 — CID 59362205

IUPACN-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)Nc3ccccc3F)o2)s1
InChIInChI=1S/C16H14FN3O4S2/c1-9-15(25-16(18-9)19-10(2)21)13-7-8-14(24-13)26(22,23)20-12-6-4-3-5-11(12)17/h3-8,20H,1-2H3,(H,18,19,21)
InChIKeyMCORERSBDKFVRB-UHFFFAOYSA-N
MW395.44 g/mol
LogP3.61
Rot. Bonds5

About N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide

N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide (PubChem CID 59362205) has the molecular formula C16H14FN3O4S2 and a molecular weight of 395.44 g/mol. Its IUPAC name is N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
PubChem CID59362205
Molecular FormulaC16H14FN3O4S2
Molecular Weight395.44 g/mol
Exact Mass395.04
IUPAC NameN-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)Nc3ccccc3F)o2)s1
InChIInChI=1S/C16H14FN3O4S2/c1-9-15(25-16(18-9)19-10(2)21)13-7-8-14(24-13)26(22,23)20-12-6-4-3-5-11(12)17/h3-8,20H,1-2H3,(H,18,19,21)
InChIKeyMCORERSBDKFVRB-UHFFFAOYSA-N
XLogP3.61
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.44
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-methyl-5-(5-methylsulfonylfuran-2-yl)-1,3-thiazol-2-yl]acetamide
CID 143638089
N-[5-[5-[(3-fluorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 59362182
N-[5-[5-[[cyano(phenyl)methyl]sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 59362186
N-[5-[5-[(3,5-dichlorophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 59362171
N-[5-[5-[benzyl(methyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;molecular hydrogen
CID 158251335
N-[5-[5-[(3-hydroxyphenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;molecular hydrogen
CID 160781972
N-[5-[5-[(3-iodophenyl)methylsulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide;molecular hydrogen
CID 159514639
5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide
CID 53085877
N-[5-[2-(benzenesulfonamido)-6-chloro-3-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 87177095
N-[5-[5-(benzenesulfonamido)-2-pyridinyl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 86620407
5-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-N-[(1R)-2-hydroxy-1-phenylethyl]furan-2-carboxamide
CID 59362159
5-(2-acetamido-4-methyl-1,3-thiazol-5-yl)furan-2-carboxylic acid;N-[5-(5-formylfuran-2-yl)-4-methyl-1,3-thiazol-2-yl]acetamide
CID 158490935

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide (CID 59362205) is N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(C)c(-c2ccc(S(=O)(=O)Nc3ccccc3F)o2)s1.
What is the InChIKey of N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
The InChIKey is MCORERSBDKFVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O4S2/c1-9-15(25-16(18-9)19-10(2)21)13-7-8-14(24-13)26(22,23)20-12-6-4-3-5-11(12)17/h3-8,20H,1-2H3,(H,18,19,21).
What are the key properties of N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide?
N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide has a molecular weight of 395.44 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[5-[(2-fluorophenyl)sulfamoyl]furan-2-yl]-4-methyl-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 59362205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).