N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide

C19H16F2N2O3S2 — CID 15990975

IUPACN-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide
SMILESCc1ccc(N(CC(=O)Nc2ccc(F)cc2F)S(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C19H16F2N2O3S2/c1-13-4-7-15(8-5-13)23(28(25,26)19-3-2-10-27-19)12-18(24)22-17-9-6-14(20)11-16(17)21/h2-11H,12H2,1H3,(H,22,24)
InChIKeyWSBPSCVOSHOORZ-UHFFFAOYSA-N
MW422.48 g/mol
LogP4.17
Rot. Bonds6

About N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide

N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide (PubChem CID 15990975) has the molecular formula C19H16F2N2O3S2 and a molecular weight of 422.48 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide
PubChem CID15990975
Molecular FormulaC19H16F2N2O3S2
Molecular Weight422.48 g/mol
Exact Mass422.06
IUPAC NameN-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide
SMILESCc1ccc(N(CC(=O)Nc2ccc(F)cc2F)S(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C19H16F2N2O3S2/c1-13-4-7-15(8-5-13)23(28(25,26)19-3-2-10-27-19)12-18(24)22-17-9-6-14(20)11-16(17)21/h2-11H,12H2,1H3,(H,22,24)
InChIKeyWSBPSCVOSHOORZ-UHFFFAOYSA-N
XLogP4.17
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.48
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide
CID 126458216
N-(2,4-difluorophenyl)-2-(N-(2-methoxy-5-methylphenyl)sulfonylanilino)acetamide
CID 126392822
2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)-N-(2,4-difluorophenyl)acetamide
CID 126030529
2-(4-methyl-N-thiophen-2-ylsulfonylanilino)-N-(thiophen-2-ylmethyl)acetamide
CID 3236370
2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-N-(3-propan-2-yloxyphenyl)acetamide
CID 30275804
N-[2-(4-methylphenyl)ethyl]-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide
CID 20855643
ethyl 2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetate
CID 100547151
2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167823
N-(2,4-dimethylphenyl)-2-(4-fluoro-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 1334839
2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-N-(3-methoxypropyl)acetamide
CID 30257544
N-[3-(dimethylamino)propyl]-2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetamide
CID 30271860
N-[2-(4-chlorophenyl)ethyl]-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide
CID 20855632

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide (CID 15990975) is N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide is Cc1ccc(N(CC(=O)Nc2ccc(F)cc2F)S(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide?
The InChIKey is WSBPSCVOSHOORZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O3S2/c1-13-4-7-15(8-5-13)23(28(25,26)19-3-2-10-27-19)12-18(24)22-17-9-6-14(20)11-16(17)21/h2-11H,12H2,1H3,(H,22,24).
What are the key properties of N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide?
N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide has a molecular weight of 422.48 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetamide is sourced from PubChem (CID 15990975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).