N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide

C18H23N3O3S — CID 58924138

IUPACN-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide
SMILESCCCCN(C)C(=O)c1ccccc1S(=O)(=O)Nc1cncc(C)c1
InChIInChI=1S/C18H23N3O3S/c1-4-5-10-21(3)18(22)16-8-6-7-9-17(16)25(23,24)20-15-11-14(2)12-19-13-15/h6-9,11-13,20H,4-5,10H2,1-3H3
InChIKeyQHFCYKJZFZRTJH-UHFFFAOYSA-N
MW361.47 g/mol
LogP3.06
Rot. Bonds7

About N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide

N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide (PubChem CID 58924138) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide
PubChem CID58924138
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC NameN-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide
SMILESCCCCN(C)C(=O)c1ccccc1S(=O)(=O)Nc1cncc(C)c1
InChIInChI=1S/C18H23N3O3S/c1-4-5-10-21(3)18(22)16-8-6-7-9-17(16)25(23,24)20-15-11-14(2)12-19-13-15/h6-9,11-13,20H,4-5,10H2,1-3H3
InChIKeyQHFCYKJZFZRTJH-UHFFFAOYSA-N
XLogP3.06
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylbutyl)-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide
CID 58924189
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
CID 58924319
N-butyl-N-methyl-2-[2-(methylamino)propylsulfamoyl]benzamide
CID 120824520
N-ethyl-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propylbenzamide
CID 58924348
5-[[2-[butyl(methyl)carbamoyl]phenyl]sulfonylamino]-N-methyl-1H-indole-2-carboxamide
CID 167957313
2-(3-aminobutylsulfamoyl)-N-butyl-N-methylbenzamide
CID 119972472
2-chloro-N-(5-methyl-3-pyridinyl)benzenesulfonamide
CID 110727391
N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 58924202
5-amino-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzoic acid
CID 107584508
5-(benzylamino)-N-butyl-N-methylpyridine-3-carboxamide
CID 109231838
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutyl)benzamide
CID 58924307
N-butyl-N-methyl-2-[[(8R)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]sulfamoyl]benzamide
CID 100640927

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide?
The IUPAC name of N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide (CID 58924138) is N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide.
What is the SMILES notation for N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide?
The canonical SMILES for N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide is CCCCN(C)C(=O)c1ccccc1S(=O)(=O)Nc1cncc(C)c1.
What is the InChIKey of N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide?
The InChIKey is QHFCYKJZFZRTJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-4-5-10-21(3)18(22)16-8-6-7-9-17(16)25(23,24)20-15-11-14(2)12-19-13-15/h6-9,11-13,20H,4-5,10H2,1-3H3.
What are the key properties of N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide?
N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide has a molecular weight of 361.47 g/mol, XLogP of 3.06, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide is sourced from PubChem (CID 58924138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).