N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide

C19H24N2O4S — CID 86853194

IUPACN-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cccc(C(=O)NC(C)CCc2ccc(OC)cc2)c1
InChIInChI=1S/C19H24N2O4S/c1-14(7-8-15-9-11-17(25-3)12-10-15)21-19(22)16-5-4-6-18(13-16)26(23,24)20-2/h4-6,9-14,20H,7-8H2,1-3H3,(H,21,22)
InChIKeyZVLZCEXALQTBJP-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.35
Rot. Bonds8

About N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide

N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide (PubChem CID 86853194) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide
PubChem CID86853194
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cccc(C(=O)NC(C)CCc2ccc(OC)cc2)c1
InChIInChI=1S/C19H24N2O4S/c1-14(7-8-15-9-11-17(25-3)12-10-15)21-19(22)16-5-4-6-18(13-16)26(23,24)20-2/h4-6,9-14,20H,7-8H2,1-3H3,(H,21,22)
InChIKeyZVLZCEXALQTBJP-UHFFFAOYSA-N
XLogP2.35
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 854833
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 3-(methylsulfamoyl)benzoate
CID 2607642
4-methoxy-3-(methylsulfamoyl)-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 40742244
2,6-dichloro-N-[4-(4-methoxyphenyl)butan-2-yl]pyridine-4-carboxamide
CID 139899503
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-3-(methylsulfamoyl)benzamide
CID 46612917
methyl 3-[[(2S)-4-phenylbutan-2-yl]sulfamoyl]benzoate
CID 31700850
3-(2-methoxyethylsulfamoyl)-N-(5-methylhexan-2-yl)benzamide
CID 134019674
3-[(3-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 109062201
N-[(4-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 18158891
3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
CID 17480198
N-[1-(4-methoxyphenyl)ethyl]-3-(phenylsulfamoyl)benzamide
CID 132663597
N-(4-methoxyphenyl)-3-[[3-(4-propan-2-ylphenyl)propanoylamino]carbamoyl]benzenesulfonamide
CID 46488488

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide?
The IUPAC name of N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide (CID 86853194) is N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide?
The canonical SMILES for N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1cccc(C(=O)NC(C)CCc2ccc(OC)cc2)c1.
What is the InChIKey of N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide?
The InChIKey is ZVLZCEXALQTBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14(7-8-15-9-11-17(25-3)12-10-15)21-19(22)16-5-4-6-18(13-16)26(23,24)20-2/h4-6,9-14,20H,7-8H2,1-3H3,(H,21,22).
What are the key properties of N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide?
N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide has a molecular weight of 376.48 g/mol, XLogP of 2.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methoxyphenyl)butan-2-yl]-3-(methylsulfamoyl)benzamide is sourced from PubChem (CID 86853194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).