2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide

C11H14Cl2N2O3S — CID 60635894

IUPAC2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide
SMILESCCN(CC)C(=O)c1cc(S(N)(=O)=O)c(Cl)cc1Cl
InChIInChI=1S/C11H14Cl2N2O3S/c1-3-15(4-2)11(16)7-5-10(19(14,17)18)9(13)6-8(7)12/h5-6H,3-4H2,1-2H3,(H2,14,17,18)
InChIKeyYYXWZRMLJFKCDN-UHFFFAOYSA-N
MW325.22 g/mol
LogP2.12
Rot. Bonds4

About 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide

2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide (PubChem CID 60635894) has the molecular formula C11H14Cl2N2O3S and a molecular weight of 325.22 g/mol. Its IUPAC name is 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide
PubChem CID60635894
Molecular FormulaC11H14Cl2N2O3S
Molecular Weight325.22 g/mol
Exact Mass324.01
IUPAC Name2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide
SMILESCCN(CC)C(=O)c1cc(S(N)(=O)=O)c(Cl)cc1Cl
InChIInChI=1S/C11H14Cl2N2O3S/c1-3-15(4-2)11(16)7-5-10(19(14,17)18)9(13)6-8(7)12/h5-6H,3-4H2,1-2H3,(H2,14,17,18)
InChIKeyYYXWZRMLJFKCDN-UHFFFAOYSA-N
XLogP2.12
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.22
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-ethyl-4-fluoro-N-(2-methoxyethyl)-5-sulfamoylbenzamide
CID 65387832
4-chloro-N,N-diethyl-2-[2-(furan-2-yl)ethyl]-5-sulfamoylbenzamide
CID 58033695
4-bromo-N,N-diethyl-2-methyl-5-sulfamoylbenzamide
CID 166390787
2,4-dichloro-N-pentyl-5-sulfamoylbenzamide
CID 60635006
bis(2,4-dichloro-5-sulfamoylbenzoic acid);ethane-1,2-diamine
CID 50942703
4,5-dichloro-1-N,1-N,2-N,2-N-tetraethylbenzene-1,2-dicarboxamide
CID 23857395
N-tert-butyl-2,4-dichloro-5-sulfamoylbenzamide
CID 60699230
4-bromo-2-chloro-N-methyl-N-(2-methylbutyl)-5-sulfamoylbenzamide
CID 65387965
2,4-dichloro-N-(2-ethoxypropyl)-5-sulfamoylbenzamide
CID 115665377
N,N-diethyl-3,4-dimethoxy-2-propan-2-yl-5-sulfamoylbenzamide
CID 23353687
2,4-dichloro-N-(3-methoxypropyl)-5-sulfamoylbenzamide
CID 60636009
2-chloro-N-ethyl-5-sulfamoyl-N-(2,2,2-trifluoroethyl)benzamide
CID 65387463

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide?
The IUPAC name of 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide (CID 60635894) is 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide.
What is the SMILES notation for 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide?
The canonical SMILES for 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide is CCN(CC)C(=O)c1cc(S(N)(=O)=O)c(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide?
The InChIKey is YYXWZRMLJFKCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O3S/c1-3-15(4-2)11(16)7-5-10(19(14,17)18)9(13)6-8(7)12/h5-6H,3-4H2,1-2H3,(H2,14,17,18).
What are the key properties of 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide?
2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide has a molecular weight of 325.22 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide is sourced from PubChem (CID 60635894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).