N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide

C15H13Cl2FN2O3S — CID 113001384

IUPACN-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
SMILESCc1cc(S(=O)(=O)NCC(=O)Nc2cc(Cl)cc(Cl)c2)ccc1F
InChIInChI=1S/C15H13Cl2FN2O3S/c1-9-4-13(2-3-14(9)18)24(22,23)19-8-15(21)20-12-6-10(16)5-11(17)7-12/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyLYMRFUDEOSMXEH-UHFFFAOYSA-N
MW391.25 g/mol
LogP3.36
Rot. Bonds5

About N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide

N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide (PubChem CID 113001384) has the molecular formula C15H13Cl2FN2O3S and a molecular weight of 391.25 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
PubChem CID113001384
Molecular FormulaC15H13Cl2FN2O3S
Molecular Weight391.25 g/mol
Exact Mass390.00
IUPAC NameN-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
SMILESCc1cc(S(=O)(=O)NCC(=O)Nc2cc(Cl)cc(Cl)c2)ccc1F
InChIInChI=1S/C15H13Cl2FN2O3S/c1-9-4-13(2-3-14(9)18)24(22,23)19-8-15(21)20-12-6-10(16)5-11(17)7-12/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyLYMRFUDEOSMXEH-UHFFFAOYSA-N
XLogP3.36
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.25
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
CID 113001324
N-(4-tert-butylphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
CID 112997610
2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 113002239
N-(4-acetamidophenyl)-2-[(4-chloro-3-methylphenyl)sulfonylamino]acetamide
CID 112999779
N-(3-chloro-4-methylphenyl)-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide
CID 112998194
2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(1-phenylethyl)acetamide
CID 112992360
2-[(3-chloro-4-fluorophenyl)sulfonylamino]-N-(3-fluorophenyl)acetamide
CID 52813347
N-(2,5-dimethoxyphenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide
CID 112999196
N-(4-tert-butylphenyl)-2-[(4-chloro-3-methylphenyl)sulfonylamino]acetamide
CID 112997620
2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-(3-methylphenyl)acetamide
CID 112996149
2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 112993355
N-(4-acetylphenyl)-2-[(4-chlorophenyl)sulfonylamino]acetamide
CID 112999628

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide (CID 113001384) is N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide is Cc1cc(S(=O)(=O)NCC(=O)Nc2cc(Cl)cc(Cl)c2)ccc1F.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
The InChIKey is LYMRFUDEOSMXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FN2O3S/c1-9-4-13(2-3-14(9)18)24(22,23)19-8-15(21)20-12-6-10(16)5-11(17)7-12/h2-7,19H,8H2,1H3,(H,20,21).
What are the key properties of N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide?
N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide has a molecular weight of 391.25 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-[(4-fluoro-3-methylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 113001384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).