2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide

C11H14Cl2N2O3S — CID 65388331

IUPAC2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide
SMILESCCCN(C)C(=O)c1cc(Cl)cc(S(N)(=O)=O)c1Cl
InChIInChI=1S/C11H14Cl2N2O3S/c1-3-4-15(2)11(16)8-5-7(12)6-9(10(8)13)19(14,17)18/h5-6H,3-4H2,1-2H3,(H2,14,17,18)
InChIKeyAMSYUPMRUAJWSV-UHFFFAOYSA-N
MW325.22 g/mol
LogP2.12
Rot. Bonds4

About 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide

2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide (PubChem CID 65388331) has the molecular formula C11H14Cl2N2O3S and a molecular weight of 325.22 g/mol. Its IUPAC name is 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide.

Molecular Properties

Compound Name2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide
PubChem CID65388331
Molecular FormulaC11H14Cl2N2O3S
Molecular Weight325.22 g/mol
Exact Mass324.01
IUPAC Name2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide
SMILESCCCN(C)C(=O)c1cc(Cl)cc(S(N)(=O)=O)c1Cl
InChIInChI=1S/C11H14Cl2N2O3S/c1-3-4-15(2)11(16)8-5-7(12)6-9(10(8)13)19(14,17)18/h5-6H,3-4H2,1-2H3,(H2,14,17,18)
InChIKeyAMSYUPMRUAJWSV-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-methyl-5-nitro-N-propyl-3-sulfamoylbenzamide
CID 65386412
N-butyl-5-chloro-N,2-dimethyl-3-sulfamoylbenzamide
CID 82890834
5-fluoro-N-methyl-N-propyl-2-sulfamoylbenzamide
CID 60876962
5-chloro-2-methyl-N-propan-2-yl-N-propyl-3-sulfamoylbenzamide
CID 82878197
3-chloro-N,4-dimethyl-N-propyl-5-sulfamoylbenzamide
CID 65387181
3,4-dichloro-N-(2-ethoxyethyl)-N-methyl-5-sulfamoylbenzamide
CID 81063673
3,4-dichloro-5-[methyl(propyl)carbamoyl]benzenesulfonyl chloride
CID 65371289
2-methoxyethyl 2,5-dichloro-3-sulfamoylbenzoate
CID 65380265
2,5-dichloro-N-(2-methylbutan-2-yl)-3-sulfamoylbenzamide
CID 65373801
2,5-dichloro-N-methyl-N-(oxolan-3-yl)-3-sulfamoylbenzamide
CID 82748225
N-butyl-2-chloro-4-fluoro-N-methyl-5-sulfamoylbenzamide
CID 65373674
3,4-dichloro-N-cyclopropyl-N-propyl-5-sulfamoylbenzamide
CID 65386602

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide?
The IUPAC name of 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide (CID 65388331) is 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide.
What is the SMILES notation for 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide?
The canonical SMILES for 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide is CCCN(C)C(=O)c1cc(Cl)cc(S(N)(=O)=O)c1Cl.
What is the InChIKey of 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide?
The InChIKey is AMSYUPMRUAJWSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O3S/c1-3-4-15(2)11(16)8-5-7(12)6-9(10(8)13)19(14,17)18/h5-6H,3-4H2,1-2H3,(H2,14,17,18).
What are the key properties of 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide?
2,5-dichloro-N-methyl-N-propyl-3-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 2,5-dichloro-N-methyl-N-propyl-3-sulfamoylbenzamide is sourced from PubChem (CID 65388331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).