4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide

C13H18N2O3S — CID 24679124

IUPAC4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide
SMILESCCN(C1CC1)S(=O)(=O)c1ccc(C(=O)NC)cc1
InChIInChI=1S/C13H18N2O3S/c1-3-15(11-6-7-11)19(17,18)12-8-4-10(5-9-12)13(16)14-2/h4-5,8-9,11H,3,6-7H2,1-2H3,(H,14,16)
InChIKeyNDFJUCWEZZTREX-UHFFFAOYSA-N
MW282.37 g/mol
LogP1.22
Rot. Bonds5

About 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide

4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide (PubChem CID 24679124) has the molecular formula C13H18N2O3S and a molecular weight of 282.37 g/mol. Its IUPAC name is 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide
PubChem CID24679124
Molecular FormulaC13H18N2O3S
Molecular Weight282.37 g/mol
Exact Mass282.10
IUPAC Name4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide
SMILESCCN(C1CC1)S(=O)(=O)c1ccc(C(=O)NC)cc1
InChIInChI=1S/C13H18N2O3S/c1-3-15(11-6-7-11)19(17,18)12-8-4-10(5-9-12)13(16)14-2/h4-5,8-9,11H,3,6-7H2,1-2H3,(H,14,16)
InChIKeyNDFJUCWEZZTREX-UHFFFAOYSA-N
XLogP1.22
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-ethyl-4-(methylamino)benzenesulfonamide
CID 43264442
4-[cyclopropyl(ethyl)sulfamoyl]benzenecarbothioamide
CID 43264374
4-acetyl-N-cyclopentyl-N-ethylbenzenesulfonamide
CID 43541526
N-cyclopropyl-N-ethyl-4-(ethylamino)benzenesulfonamide
CID 62143418
4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]-N-methylbenzamide
CID 24679199
4-[[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]methyl]-N-methylbenzamide
CID 24679207
N-cyclopentyl-N-ethyl-4-(methylamino)benzenesulfonamide
CID 43541535
4-[cyclohexyl(ethyl)sulfamoyl]benzenecarbothioamide
CID 43107449
N-cyclopentyl-N-ethyl-4-ethylsulfonylbenzenesulfonamide
CID 87024719
N-cyclopropyl-N-ethyl-4-(propylaminomethyl)benzenesulfonamide
CID 60824957
4-[cyclohexyl(ethyl)sulfamoyl]-N-(2-methyl-1,3-dioxoisoindol-5-yl)benzamide
CID 41149330
4-[[cyclopropyl-(4-methylsulfonylbenzoyl)amino]methyl]-N-methylbenzamide
CID 33351444

Frequently Asked Questions

What is the IUPAC name of 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide?
The IUPAC name of 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide (CID 24679124) is 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide.
What is the SMILES notation for 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide?
The canonical SMILES for 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide is CCN(C1CC1)S(=O)(=O)c1ccc(C(=O)NC)cc1.
What is the InChIKey of 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide?
The InChIKey is NDFJUCWEZZTREX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-3-15(11-6-7-11)19(17,18)12-8-4-10(5-9-12)13(16)14-2/h4-5,8-9,11H,3,6-7H2,1-2H3,(H,14,16).
What are the key properties of 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide?
4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide has a molecular weight of 282.37 g/mol, XLogP of 1.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopropyl(ethyl)sulfamoyl]-N-methylbenzamide is sourced from PubChem (CID 24679124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).