N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide

C19H24N2O4S — CID 109065384

IUPACN-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide
SMILESCCCCCNS(=O)(=O)c1cccc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C19H24N2O4S/c1-3-4-7-13-20-26(23,24)16-10-8-9-15(14-16)19(22)21-17-11-5-6-12-18(17)25-2/h5-6,8-12,14,20H,3-4,7,13H2,1-2H3,(H,21,22)
InChIKeyBLGBZZSDDOTBOV-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.42
Rot. Bonds9

About N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide

N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide (PubChem CID 109065384) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide
PubChem CID109065384
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide
SMILESCCCCCNS(=O)(=O)c1cccc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C19H24N2O4S/c1-3-4-7-13-20-26(23,24)16-10-8-9-15(14-16)19(22)21-17-11-5-6-12-18(17)25-2/h5-6,8-12,14,20H,3-4,7,13H2,1-2H3,(H,21,22)
InChIKeyBLGBZZSDDOTBOV-UHFFFAOYSA-N
XLogP3.42
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-ethoxyphenyl)-3-(propylsulfamoyl)benzamide
CID 109061947
N-[5-(butylsulfamoyl)-2-methoxyphenyl]-3-chlorobenzamide
CID 4983601
3-(butylsulfamoyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 17226790
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
N-(2-bromophenyl)-3-(butylsulfamoyl)benzamide
CID 17226776
N-butyl-2-[[3-(butylsulfamoyl)benzoyl]amino]benzamide
CID 17226854
N-(4-chloro-2-methylphenyl)-3-(pentylsulfamoyl)benzamide
CID 109065381
3-(ethylsulfamoyl)-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 33069732
3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide
CID 17226677
N-(2,4-dimethoxyphenyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063596
N-[2-methoxy-5-(pentylsulfamoyl)phenyl]acetamide
CID 8777676
N-(2-cyanophenyl)-3-(3-methoxypropylsulfamoyl)benzamide
CID 109063792

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide?
The IUPAC name of N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide (CID 109065384) is N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide?
The canonical SMILES for N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide is CCCCCNS(=O)(=O)c1cccc(C(=O)Nc2ccccc2OC)c1.
What is the InChIKey of N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide?
The InChIKey is BLGBZZSDDOTBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-3-4-7-13-20-26(23,24)16-10-8-9-15(14-16)19(22)21-17-11-5-6-12-18(17)25-2/h5-6,8-12,14,20H,3-4,7,13H2,1-2H3,(H,21,22).
What are the key properties of N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide?
N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide has a molecular weight of 376.48 g/mol, XLogP of 3.42, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide is sourced from PubChem (CID 109065384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).