3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide

C15H14F2N2O3S — CID 38893186

IUPAC3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide
SMILESNC(=O)CCN(c1ccccc1)S(=O)(=O)c1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O3S/c16-11-8-12(17)10-14(9-11)23(21,22)19(7-6-15(18)20)13-4-2-1-3-5-13/h1-5,8-10H,6-7H2,(H2,18,20)
InChIKeyNJWMDANKZUEQEN-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.04
Rot. Bonds6

About 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide

3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide (PubChem CID 38893186) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide.

Molecular Properties

Compound Name3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide
PubChem CID38893186
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC Name3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide
SMILESNC(=O)CCN(c1ccccc1)S(=O)(=O)c1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O3S/c16-11-8-12(17)10-14(9-11)23(21,22)19(7-6-15(18)20)13-4-2-1-3-5-13/h1-5,8-10H,6-7H2,(H2,18,20)
InChIKeyNJWMDANKZUEQEN-UHFFFAOYSA-N
XLogP2.04
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(N-(4-tert-butylphenyl)sulfonylanilino)propanamide
CID 38893159
3-(N-(3-chloro-4-methyl-5-nitrophenyl)sulfonylanilino)propanamide
CID 38893102
N-ethyl-3-fluoro-5-methyl-N-phenylbenzenesulfonamide
CID 96566606
3-(N-(2-bromo-4-methylphenyl)sulfonylanilino)propanamide
CID 38893058
3-(N-(4-chloro-3-nitrophenyl)sulfonyl-4-fluoroanilino)propanamide
CID 86886982
3-fluoro-N-phenyl-N-propylbenzenesulfonamide
CID 142103274
3-(N-(2,5-dimethylfuran-3-yl)sulfonyl-4-fluoroanilino)propanamide
CID 75445266
4-(N-(3,4-dichlorophenyl)sulfonylanilino)butanoic acid
CID 50889582
3-[N-(1H-pyrrol-3-ylsulfonyl)anilino]propanoic acid
CID 60830003
3-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]propanoic acid
CID 50893221
N-benzyl-2-(N-(4-fluorophenyl)sulfonylanilino)acetamide
CID 4240741
3-[N-(benzenesulfonyl)-4-chloroanilino]propanoic acid
CID 50890227

Frequently Asked Questions

What is the IUPAC name of 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide?
The IUPAC name of 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide (CID 38893186) is 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide.
What is the SMILES notation for 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide?
The canonical SMILES for 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide is NC(=O)CCN(c1ccccc1)S(=O)(=O)c1cc(F)cc(F)c1.
What is the InChIKey of 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide?
The InChIKey is NJWMDANKZUEQEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c16-11-8-12(17)10-14(9-11)23(21,22)19(7-6-15(18)20)13-4-2-1-3-5-13/h1-5,8-10H,6-7H2,(H2,18,20).
What are the key properties of 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide?
3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide has a molecular weight of 340.35 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N-(3,5-difluorophenyl)sulfonylanilino)propanamide is sourced from PubChem (CID 38893186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).