N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine

C11H19N3O3S — CID 68596264

IUPACN-ethyl-4-sulfamoylbenzamide;N-methylmethanamine
SMILESCCNC(=O)c1ccc(S(N)(=O)=O)cc1.CNC
InChIInChI=1S/C9H12N2O3S.C2H7N/c1-2-11-9(12)7-3-5-8(6-4-7)15(10,13)14;1-3-2/h3-6H,2H2,1H3,(H,11,12)(H2,10,13,14);3H,1-2H3
InChIKeyXFDLXCWHSSXAAL-UHFFFAOYSA-N
MW273.36 g/mol
LogP-0.08
Rot. Bonds3

About N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine

N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine (PubChem CID 68596264) has the molecular formula C11H19N3O3S and a molecular weight of 273.36 g/mol. Its IUPAC name is N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine.

Molecular Properties

Compound NameN-ethyl-4-sulfamoylbenzamide;N-methylmethanamine
PubChem CID68596264
Molecular FormulaC11H19N3O3S
Molecular Weight273.36 g/mol
Exact Mass273.11
IUPAC NameN-ethyl-4-sulfamoylbenzamide;N-methylmethanamine
SMILESCCNC(=O)c1ccc(S(N)(=O)=O)cc1.CNC
InChIInChI=1S/C9H12N2O3S.C2H7N/c1-2-11-9(12)7-3-5-8(6-4-7)15(10,13)14;1-3-2/h3-6H,2H2,1H3,(H,11,12)(H2,10,13,14);3H,1-2H3
InChIKeyXFDLXCWHSSXAAL-UHFFFAOYSA-N
XLogP-0.08
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-sulfamoylbenzamide
CID 10242881
N-methylethanamine;N-propyl-4-sulfamoylbenzamide
CID 68599383
N-ethyl-4-[[(4-sulfamoylphenyl)sulfonylamino]methyl]benzamide
CID 55904950
N-ethyl-3-sulfamoylbenzamide
CID 43089872
N-(3-oxobutyl)-4-sulfamoylbenzamide
CID 23579196
N-ethylbutan-1-amine;N-propyl-4-sulfamoylbenzamide
CID 68609461
N-(2-methyl-2-methylsulfonylpropyl)-4-sulfamoylbenzamide
CID 79559148
N-butylbutan-1-amine;N-propyl-4-sulfamoylbenzamide
CID 68610816
4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
CID 79359507
N-ethyl-4-pyrrolidin-1-ylsulfonylbenzamide
CID 26264709
N-(2-bromoprop-2-enyl)-4-sulfamoylbenzamide
CID 47441752
2-[[2-[[2-[[2-[[2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic acid
CID 10325079

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine?
The IUPAC name of N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine (CID 68596264) is N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine.
What is the SMILES notation for N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine?
The canonical SMILES for N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine is CCNC(=O)c1ccc(S(N)(=O)=O)cc1.CNC.
What is the InChIKey of N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine?
The InChIKey is XFDLXCWHSSXAAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3S.C2H7N/c1-2-11-9(12)7-3-5-8(6-4-7)15(10,13)14;1-3-2/h3-6H,2H2,1H3,(H,11,12)(H2,10,13,14);3H,1-2H3.
What are the key properties of N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine?
N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine has a molecular weight of 273.36 g/mol, XLogP of -0.08, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine is sourced from PubChem (CID 68596264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).