N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide

C14H20N2O4S — CID 115687261

IUPACN-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)NCCC1CCC1
InChIInChI=1S/C14H20N2O4S/c1-20-13-6-5-11(21(15,18)19)9-12(13)14(17)16-8-7-10-3-2-4-10/h5-6,9-10H,2-4,7-8H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyMDFLBEFAPAFWNP-UHFFFAOYSA-N
MW312.39 g/mol
LogP1.26
Rot. Bonds6

About N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide

N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide (PubChem CID 115687261) has the molecular formula C14H20N2O4S and a molecular weight of 312.39 g/mol. Its IUPAC name is N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide
PubChem CID115687261
Molecular FormulaC14H20N2O4S
Molecular Weight312.39 g/mol
Exact Mass312.11
IUPAC NameN-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)NCCC1CCC1
InChIInChI=1S/C14H20N2O4S/c1-20-13-6-5-11(21(15,18)19)9-12(13)14(17)16-8-7-10-3-2-4-10/h5-6,9-10H,2-4,7-8H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyMDFLBEFAPAFWNP-UHFFFAOYSA-N
XLogP1.26
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-butyl-2-methoxy-5-sulfamoylbenzamide
CID 31321939
N-ethyl-2-methoxy-5-sulfamoylbenzamide
CID 6473438
N-(cyclobutylmethyl)-2-methoxy-N-methyl-5-sulfamoylbenzamide
CID 63933053
N-(2-cyclopropylpropyl)-2-methoxy-5-sulfamoylbenzamide
CID 115591271
2-methoxy-N-(oxolan-2-ylmethyl)-5-sulfamoylbenzamide
CID 4883084
N-[[(2S)-1-(cyclopentylmethyl)pyrrolidin-2-yl]methyl]-2-methoxy-5-sulfamoylbenzamide
CID 70606438
N-[2-(cyclohexen-1-yl)ethyl]-2-methoxy-5-sulfamoylbenzamide
CID 25469750
N-(1-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide
CID 115769101
2-methoxy-N-[3-(4-methylpiperazin-1-yl)propyl]-5-sulfamoylbenzamide
CID 3075862
N-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-2-methoxy-5-sulfamoylbenzamide
CID 9162988
2-methoxy-N-(3-propan-2-yloxypropyl)-5-sulfamoylbenzamide
CID 9292499
2-methoxy-N-(3-phenylpropyl)-5-sulfamoylbenzamide
CID 4796456

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide?
The IUPAC name of N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide (CID 115687261) is N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide.
What is the SMILES notation for N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide?
The canonical SMILES for N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide is COc1ccc(S(N)(=O)=O)cc1C(=O)NCCC1CCC1.
What is the InChIKey of N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide?
The InChIKey is MDFLBEFAPAFWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4S/c1-20-13-6-5-11(21(15,18)19)9-12(13)14(17)16-8-7-10-3-2-4-10/h5-6,9-10H,2-4,7-8H2,1H3,(H,16,17)(H2,15,18,19).
What are the key properties of N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide?
N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide has a molecular weight of 312.39 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide is sourced from PubChem (CID 115687261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).