N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide

C19H24N2O3S — CID 26558348

IUPACN-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide
SMILESCc1ccccc1CN(C)C(=O)c1ccc(S(=O)(=O)NC(C)C)cc1
InChIInChI=1S/C19H24N2O3S/c1-14(2)20-25(23,24)18-11-9-16(10-12-18)19(22)21(4)13-17-8-6-5-7-15(17)3/h5-12,14,20H,13H2,1-4H3
InChIKeyRAPFJZTXQADUGL-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.95
Rot. Bonds6

About N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide

N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide (PubChem CID 26558348) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide
PubChem CID26558348
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide
SMILESCc1ccccc1CN(C)C(=O)c1ccc(S(=O)(=O)NC(C)C)cc1
InChIInChI=1S/C19H24N2O3S/c1-14(2)20-25(23,24)18-11-9-16(10-12-18)19(22)21(4)13-17-8-6-5-7-15(17)3/h5-12,14,20H,13H2,1-4H3
InChIKeyRAPFJZTXQADUGL-UHFFFAOYSA-N
XLogP2.95
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(2-methylphenyl)methyl]-4-(phenylsulfamoyl)benzamide
CID 9368880
1-methyl-1-[(2-methylphenyl)methyl]-3-[4-(propan-2-ylsulfamoyl)phenyl]urea
CID 86987903
4-ethylsulfonyl-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 51098556
4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]-3-(propan-2-ylsulfamoyl)benzamide
CID 51161410
N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9227970
4-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 60631099
N-methyl-N-(3-methylbutyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 86926868
methyl 4-[methyl-[(2-methylphenyl)methyl]carbamoyl]benzoate
CID 9368938
N-[(2-fluorophenyl)methyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-methylbenzamide
CID 9372844
4-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 62175917
N-methyl-N-[(2-methylphenyl)methyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide
CID 26558363
N-methyl-N-[(2-methylphenyl)methyl]-4-nitrobenzamide
CID 27827757

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide?
The IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide (CID 26558348) is N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide.
What is the SMILES notation for N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide?
The canonical SMILES for N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide is Cc1ccccc1CN(C)C(=O)c1ccc(S(=O)(=O)NC(C)C)cc1.
What is the InChIKey of N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide?
The InChIKey is RAPFJZTXQADUGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14(2)20-25(23,24)18-11-9-16(10-12-18)19(22)21(4)13-17-8-6-5-7-15(17)3/h5-12,14,20H,13H2,1-4H3.
What are the key properties of N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide?
N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide has a molecular weight of 360.48 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylphenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide is sourced from PubChem (CID 26558348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).