2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide

C16H14ClF2NO4S — CID 24614465

IUPAC2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide
SMILESO=C(CS(=O)(=O)c1ccc(Cl)cc1)NCc1ccccc1OC(F)F
InChIInChI=1S/C16H14ClF2NO4S/c17-12-5-7-13(8-6-12)25(22,23)10-15(21)20-9-11-3-1-2-4-14(11)24-16(18)19/h1-8,16H,9-10H2,(H,20,21)
InChIKeyIPUSJBSZVTVWKO-UHFFFAOYSA-N
MW389.81 g/mol
LogP3.03
Rot. Bonds7

About 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide

2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide (PubChem CID 24614465) has the molecular formula C16H14ClF2NO4S and a molecular weight of 389.81 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide
PubChem CID24614465
Molecular FormulaC16H14ClF2NO4S
Molecular Weight389.81 g/mol
Exact Mass389.03
IUPAC Name2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide
SMILESO=C(CS(=O)(=O)c1ccc(Cl)cc1)NCc1ccccc1OC(F)F
InChIInChI=1S/C16H14ClF2NO4S/c17-12-5-7-13(8-6-12)25(22,23)10-15(21)20-9-11-3-1-2-4-14(11)24-16(18)19/h1-8,16H,9-10H2,(H,20,21)
InChIKeyIPUSJBSZVTVWKO-UHFFFAOYSA-N
XLogP3.03
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.81
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenyl)sulfonyl-N-[(2-fluorophenyl)methyl]acetamide
CID 34381808
6-amino-N-[[2-(difluoromethoxy)phenyl]methyl]hexanamide
CID 61252840
2-[2-[[2-(difluoromethoxy)phenyl]methylamino]-2-oxoethoxy]acetic acid
CID 60711310
2-(benzenesulfonyl)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 112779682
2-benzhydryloxy-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide
CID 30253696
N-[[2-(difluoromethoxy)phenyl]methyl]-2-(4-methoxyphenyl)acetamide
CID 17455488
5-[[2-(difluoromethoxy)phenyl]methylamino]-3-methyl-5-oxopentanoic acid
CID 62965388
N-[2-chloro-4-[[2-(difluoromethoxy)phenyl]methylsulfamoyl]phenyl]acetamide
CID 3806370
N-[2-(benzenesulfonyl)ethyl]-2-(4-chlorophenyl)sulfonylacetamide
CID 2765509
N-[[2-(difluoromethoxy)phenyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430390
2-chloro-N-[1-[[2-(difluoromethoxy)phenyl]methylamino]-1-oxopropan-2-yl]benzamide
CID 42933502
3-cyclopentyl-N-[[2-(difluoromethoxy)phenyl]methyl]propanamide
CID 86915882

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide (CID 24614465) is 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide is O=C(CS(=O)(=O)c1ccc(Cl)cc1)NCc1ccccc1OC(F)F.
What is the InChIKey of 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide?
The InChIKey is IPUSJBSZVTVWKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClF2NO4S/c17-12-5-7-13(8-6-12)25(22,23)10-15(21)20-9-11-3-1-2-4-14(11)24-16(18)19/h1-8,16H,9-10H2,(H,20,21).
What are the key properties of 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide?
2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide has a molecular weight of 389.81 g/mol, XLogP of 3.03, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonyl-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide is sourced from PubChem (CID 24614465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).