N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide

C15H13ClF2N2O3S — CID 26578624

IUPACN-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H13ClF2N2O3S/c16-10-2-1-3-11(8-10)20-15(21)6-7-19-24(22,23)12-4-5-13(17)14(18)9-12/h1-5,8-9,19H,6-7H2,(H,20,21)
InChIKeyNOEGYIWSVPLERN-UHFFFAOYSA-N
MW374.80 g/mol
LogP2.93
Rot. Bonds6

About N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide

N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide (PubChem CID 26578624) has the molecular formula C15H13ClF2N2O3S and a molecular weight of 374.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide
PubChem CID26578624
Molecular FormulaC15H13ClF2N2O3S
Molecular Weight374.80 g/mol
Exact Mass374.03
IUPAC NameN-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H13ClF2N2O3S/c16-10-2-1-3-11(8-10)20-15(21)6-7-19-24(22,23)12-4-5-13(17)14(18)9-12/h1-5,8-9,19H,6-7H2,(H,20,21)
InChIKeyNOEGYIWSVPLERN-UHFFFAOYSA-N
XLogP2.93
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.80
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide
CID 34830305
3-[(3,4-difluorophenyl)sulfonylamino]-N-[3-[(dimethylamino)methyl]phenyl]propanamide
CID 86979332
4-[3-[(3-chlorophenyl)sulfonylamino]propanoylamino]benzamide
CID 26636174
N-(3-fluorophenyl)-3-[(4-fluorophenyl)sulfonylamino]propanamide
CID 17192108
N-(5-chloro-2-methoxyphenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide
CID 26582388
N-(3-chlorophenyl)-3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]propanamide
CID 126458383
3-[(3,4-difluorophenyl)sulfonylamino]-N-methylpropanamide
CID 47101515
3-[(4-chlorophenyl)sulfonylamino]-N-(3-propan-2-ylphenyl)propanamide
CID 9246818
3-(benzenesulfonamido)-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]propanamide
CID 55347189
3-(benzenesulfonamido)-N-(3-fluorophenyl)propanamide
CID 9412312
3-[(3,4-difluorophenyl)sulfonylamino]-N-(1H-indazol-5-yl)propanamide
CID 134037444
N-[3-(butylsulfamoyl)phenyl]-3-(3,4-difluorophenyl)propanamide
CID 46547078

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide?
The IUPAC name of N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide (CID 26578624) is N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide?
The canonical SMILES for N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide is O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide?
The InChIKey is NOEGYIWSVPLERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2N2O3S/c16-10-2-1-3-11(8-10)20-15(21)6-7-19-24(22,23)12-4-5-13(17)14(18)9-12/h1-5,8-9,19H,6-7H2,(H,20,21).
What are the key properties of N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide?
N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide has a molecular weight of 374.80 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-[(3,4-difluorophenyl)sulfonylamino]propanamide is sourced from PubChem (CID 26578624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).