2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide

C13H12ClFN2O3S2 — CID 18229081

IUPAC2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide
SMILESNS(=O)(=O)c1ccc(CNC(=O)Cc2c(F)cccc2Cl)s1
InChIInChI=1S/C13H12ClFN2O3S2/c14-10-2-1-3-11(15)9(10)6-12(18)17-7-8-4-5-13(21-8)22(16,19)20/h1-5H,6-7H2,(H,17,18)(H2,16,19,20)
InChIKeyRXFHSUXPQDSNPF-UHFFFAOYSA-N
MW362.84 g/mol
LogP2.05
Rot. Bonds5

About 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide

2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide (PubChem CID 18229081) has the molecular formula C13H12ClFN2O3S2 and a molecular weight of 362.84 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide
PubChem CID18229081
Molecular FormulaC13H12ClFN2O3S2
Molecular Weight362.84 g/mol
Exact Mass362.00
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide
SMILESNS(=O)(=O)c1ccc(CNC(=O)Cc2c(F)cccc2Cl)s1
InChIInChI=1S/C13H12ClFN2O3S2/c14-10-2-1-3-11(15)9(10)6-12(18)17-7-8-4-5-13(21-8)22(16,19)20/h1-5H,6-7H2,(H,17,18)(H2,16,19,20)
InChIKeyRXFHSUXPQDSNPF-UHFFFAOYSA-N
XLogP2.05
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.84
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dichloro-N-[(5-sulfamoylthiophen-2-yl)methyl]benzamide
CID 43242454
2,3-difluoro-N-[(5-sulfamoylthiophen-2-yl)methyl]benzamide
CID 62662253
2-(2-chloro-6-fluorophenyl)-N-[[5-(thiophene-3-carbonyl)thiophen-2-yl]methyl]acetamide
CID 72717694
N-(2-amino-2-methylpropyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 81483240
2-(2-chloro-6-fluorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2161159
2-(2-chloro-6-fluorophenyl)-N-[[4-(chloromethyl)phenyl]methyl]acetamide
CID 107233350
2-(2-chloro-6-fluorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 63310904
4-bromo-2-fluoro-N-[(5-sulfamoylthiophen-2-yl)methyl]benzamide
CID 43242545
2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-2-oxoacetic acid
CID 2780091
2-(2-chloro-6-fluorophenyl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]acetamide
CID 17478720
N-(2-bromoprop-2-enyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 115594615
N-[(2-chloro-6-fluorophenyl)methyl]-2-hydroxyacetamide
CID 82127264

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide (CID 18229081) is 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide is NS(=O)(=O)c1ccc(CNC(=O)Cc2c(F)cccc2Cl)s1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide?
The InChIKey is RXFHSUXPQDSNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClFN2O3S2/c14-10-2-1-3-11(15)9(10)6-12(18)17-7-8-4-5-13(21-8)22(16,19)20/h1-5H,6-7H2,(H,17,18)(H2,16,19,20).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide?
2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide has a molecular weight of 362.84 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 18229081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).