3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide

C19H24N2O4S — CID 94623465

IUPAC3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide
SMILESCc1ccccc1OC[C@H](C)NC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C19H24N2O4S/c1-14-8-5-6-11-18(14)25-13-15(2)20-19(22)16-9-7-10-17(12-16)26(23,24)21(3)4/h5-12,15H,13H2,1-4H3,(H,20,22)/t15-/m0/s1
InChIKeyFQCAPGMAMFBMRE-HNNXBMFYSA-N
MW376.48 g/mol
LogP2.44
Rot. Bonds7

About 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide

3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide (PubChem CID 94623465) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide
PubChem CID94623465
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide
SMILESCc1ccccc1OC[C@H](C)NC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C19H24N2O4S/c1-14-8-5-6-11-18(14)25-13-15(2)20-19(22)16-9-7-10-17(12-16)26(23,24)21(3)4/h5-12,15H,13H2,1-4H3,(H,20,22)/t15-/m0/s1
InChIKeyFQCAPGMAMFBMRE-HNNXBMFYSA-N
XLogP2.44
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(dimethylsulfamoyl)-N-[(2R)-1-phenoxypropan-2-yl]benzamide
CID 94625046
N-[(2S)-1-(2-methylphenoxy)propan-2-yl]-3-pyrrolidin-1-ylsulfonylbenzamide
CID 94623525
3-chloro-N-[1-(2-methylphenoxy)propan-2-yl]benzamide
CID 50874611
2-[benzenesulfonyl(methyl)amino]-N-[1-(2-methylphenoxy)propan-2-yl]benzamide
CID 132671490
N-[(2S)-1-(2-methylphenoxy)propan-2-yl]-3-nitrobenzamide
CID 94623549
3-(dimethylsulfamoyl)-N-[(2S)-3-methylbutan-2-yl]benzamide
CID 8923186
4-[ethyl(ethylsulfonyl)amino]-N-[(2R)-1-(2-methylphenoxy)propan-2-yl]benzamide
CID 125042751
N-[1-(3,4-dimethylphenyl)ethyl]-3-(dimethylsulfamoyl)benzamide
CID 133231354
3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 2221549
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591093
3-(dimethylsulfamoyl)-N-[(1R)-1-phenylpropyl]benzamide
CID 100625308
N-butan-2-yl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 133231331

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide (CID 94623465) is 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide is Cc1ccccc1OC[C@H](C)NC(=O)c1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide?
The InChIKey is FQCAPGMAMFBMRE-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14-8-5-6-11-18(14)25-13-15(2)20-19(22)16-9-7-10-17(12-16)26(23,24)21(3)4/h5-12,15H,13H2,1-4H3,(H,20,22)/t15-/m0/s1.
What are the key properties of 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide?
3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide has a molecular weight of 376.48 g/mol, XLogP of 2.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]benzamide is sourced from PubChem (CID 94623465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).