N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide

C16H16Cl2N2O3S — CID 5075918

IUPACN-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1Cl
InChIInChI=1S/C16H16Cl2N2O3S/c1-10(2)16(21)19-15-9-13(6-7-14(15)18)24(22,23)20-12-5-3-4-11(17)8-12/h3-10,20H,1-2H3,(H,19,21)
InChIKeyGOBXOVFUEQQFCO-UHFFFAOYSA-N
MW387.29 g/mol
LogP4.39
Rot. Bonds5

About N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide

N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide (PubChem CID 5075918) has the molecular formula C16H16Cl2N2O3S and a molecular weight of 387.29 g/mol. Its IUPAC name is N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide
PubChem CID5075918
Molecular FormulaC16H16Cl2N2O3S
Molecular Weight387.29 g/mol
Exact Mass386.03
IUPAC NameN-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1Cl
InChIInChI=1S/C16H16Cl2N2O3S/c1-10(2)16(21)19-15-9-13(6-7-14(15)18)24(22,23)20-12-5-3-4-11(17)8-12/h3-10,20H,1-2H3,(H,19,21)
InChIKeyGOBXOVFUEQQFCO-UHFFFAOYSA-N
XLogP4.39
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.29
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide?
The IUPAC name of N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide (CID 5075918) is N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide?
The canonical SMILES for N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide is CC(C)C(=O)Nc1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1Cl.
What is the InChIKey of N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide?
The InChIKey is GOBXOVFUEQQFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O3S/c1-10(2)16(21)19-15-9-13(6-7-14(15)18)24(22,23)20-12-5-3-4-11(17)8-12/h3-10,20H,1-2H3,(H,19,21).
What are the key properties of N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide?
N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide has a molecular weight of 387.29 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-[(3-chlorophenyl)sulfamoyl]phenyl]-2-methylpropanamide is sourced from PubChem (CID 5075918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).