N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide

C16H16Cl2N2O3S — CID 2380645

IUPACN-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C16H16Cl2N2O3S/c1-11-2-5-13(6-3-11)24(22,23)19-9-8-16(21)20-12-4-7-14(17)15(18)10-12/h2-7,10,19H,8-9H2,1H3,(H,20,21)
InChIKeySCXQCNOSHGFWHV-UHFFFAOYSA-N
MW387.29 g/mol
LogP3.61
Rot. Bonds6

About N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide

N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide (PubChem CID 2380645) has the molecular formula C16H16Cl2N2O3S and a molecular weight of 387.29 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
PubChem CID2380645
Molecular FormulaC16H16Cl2N2O3S
Molecular Weight387.29 g/mol
Exact Mass386.03
IUPAC NameN-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C16H16Cl2N2O3S/c1-11-2-5-13(6-3-11)24(22,23)19-9-8-16(21)20-12-4-7-14(17)15(18)10-12/h2-7,10,19H,8-9H2,1H3,(H,20,21)
InChIKeySCXQCNOSHGFWHV-UHFFFAOYSA-N
XLogP3.61
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.29
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3,4-Dichlorophenyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 2242987
2-(4-chloroanilino)-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 164614642
N-(3-chloro-2-methylphenyl)-2-(N-(4-chlorophenyl)phenylsulfonamido)acetamide
CID 1153925
4-[3-(3,4-Dichloro-phenyl)-5-methyl-2-oxo-2,3-dihydro-oxazol-4-yl]-benzenesulfonamide
CID 10763435
N-[3-(3,4-dichloroanilino)propyl]-3-[4-(methanesulfonamido)phenyl]propanamide
CID 46227072
N-(2-(3,4-Dichlorophenylamino)ethyl)-3-(4-(methylsulfonamido)phenyl)propanamide
CID 46227092
N-(3,4-dichlorophenyl)-1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide
CID 71540946
N-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)methyl]-4-methylbenzenesulfonamide
CID 1162872
N-(3-chloro-4-methylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide
CID 1327087
N~2~-(3,4-dichlorophenyl)-N~1~-{3-[methyl(methylsulfonyl)amino]phenyl}-N~2~-[(4-methylphenyl)sulfonyl]glycinamide
CID 2233458
N-(3-chlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
CID 2511495
N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-[(phenylmethyl)amino]acetamide
CID 4520711

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
The IUPAC name of N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide (CID 2380645) is N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide is Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
The InChIKey is SCXQCNOSHGFWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O3S/c1-11-2-5-13(6-3-11)24(22,23)19-9-8-16(21)20-12-4-7-14(17)15(18)10-12/h2-7,10,19H,8-9H2,1H3,(H,20,21).
What are the key properties of N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide?
N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide has a molecular weight of 387.29 g/mol, XLogP of 3.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 2380645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).