2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide

C17H25ClN2O4S — CID 2533455

IUPAC2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1Cl
InChIInChI=1S/C17H25ClN2O4S/c1-20(13-6-4-3-5-7-13)25(22,23)14-8-9-16(18)15(12-14)17(21)19-10-11-24-2/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,19,21)
InChIKeyQNBXSOFYTMPWGU-UHFFFAOYSA-N
MW388.92 g/mol
LogP2.67
Rot. Bonds7

About 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide

2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide (PubChem CID 2533455) has the molecular formula C17H25ClN2O4S and a molecular weight of 388.92 g/mol. Its IUPAC name is 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
PubChem CID2533455
Molecular FormulaC17H25ClN2O4S
Molecular Weight388.92 g/mol
Exact Mass388.12
IUPAC Name2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1Cl
InChIInChI=1S/C17H25ClN2O4S/c1-20(13-6-4-3-5-7-13)25(22,23)14-8-9-16(18)15(12-14)17(21)19-10-11-24-2/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,19,21)
InChIKeyQNBXSOFYTMPWGU-UHFFFAOYSA-N
XLogP2.67
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.92
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
The IUPAC name of 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide (CID 2533455) is 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1Cl.
What is the InChIKey of 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
The InChIKey is QNBXSOFYTMPWGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2O4S/c1-20(13-6-4-3-5-7-13)25(22,23)14-8-9-16(18)15(12-14)17(21)19-10-11-24-2/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,19,21).
What are the key properties of 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide has a molecular weight of 388.92 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[cyclohexyl(methyl)sulfamoyl]-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 2533455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).