2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide

C14H20N2O3S — CID 113246084

IUPAC2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide
SMILESCCCC1CC1NC(=O)c1cc(S(N)(=O)=O)ccc1C
InChIInChI=1S/C14H20N2O3S/c1-3-4-10-7-13(10)16-14(17)12-8-11(20(15,18)19)6-5-9(12)2/h5-6,8,10,13H,3-4,7H2,1-2H3,(H,16,17)(H2,15,18,19)
InChIKeyCLSRUMKFEFUKLJ-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.56
Rot. Bonds5

About 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide

2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide (PubChem CID 113246084) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide.

Molecular Properties

Compound Name2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide
PubChem CID113246084
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide
SMILESCCCC1CC1NC(=O)c1cc(S(N)(=O)=O)ccc1C
InChIInChI=1S/C14H20N2O3S/c1-3-4-10-7-13(10)16-14(17)12-8-11(20(15,18)19)6-5-9(12)2/h5-6,8,10,13H,3-4,7H2,1-2H3,(H,16,17)(H2,15,18,19)
InChIKeyCLSRUMKFEFUKLJ-UHFFFAOYSA-N
XLogP1.56
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide
CID 103713869
N-[(1S,2R)-2-aminocyclobutyl]-2-methyl-5-sulfamoylbenzamide
CID 56884915
2-hydroxy-5-methyl-N-(2-propylcyclopropyl)benzamide
CID 113246155
3-hydroxy-2-methyl-N-(2-propylcyclopropyl)benzamide
CID 103873583
4-bromo-N-(2-propylcyclopropyl)-3-sulfamoylbenzamide
CID 103713871
2-methyl-N-pentan-2-yl-5-sulfamoylbenzamide
CID 46522108
2-methyl-N-(2-methylbutyl)-5-sulfamoylbenzamide
CID 62692492
methyl 4-[(2-methyl-5-sulfamoylbenzoyl)amino]piperidine-1-carboxylate
CID 47072778
2-methyl-N-[4-(propanoylamino)phenyl]-5-sulfamoylbenzamide
CID 55846368
N-(1-cyclopropylpropan-2-yl)-2-methyl-5-sulfamoylbenzamide
CID 63994388
N-(2,2-difluoroethyl)-2-methyl-5-sulfamoylbenzamide
CID 79079912
N-[(3S,7S,8aS)-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]-2-methyl-5-sulfamoylbenzamide
CID 155496416

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide?
The IUPAC name of 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide (CID 113246084) is 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide.
What is the SMILES notation for 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide?
The canonical SMILES for 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide is CCCC1CC1NC(=O)c1cc(S(N)(=O)=O)ccc1C.
What is the InChIKey of 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide?
The InChIKey is CLSRUMKFEFUKLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-3-4-10-7-13(10)16-14(17)12-8-11(20(15,18)19)6-5-9(12)2/h5-6,8,10,13H,3-4,7H2,1-2H3,(H,16,17)(H2,15,18,19).
What are the key properties of 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide?
2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide has a molecular weight of 296.39 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-propylcyclopropyl)-5-sulfamoylbenzamide is sourced from PubChem (CID 113246084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).