2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide

C19H24N2O4S — CID 24554461

IUPAC2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide
SMILESCNS(=O)(=O)Cc1ccccc1CNC(=O)C(C)Oc1cccc(C)c1
InChIInChI=1S/C19H24N2O4S/c1-14-7-6-10-18(11-14)25-15(2)19(22)21-12-16-8-4-5-9-17(16)13-26(23,24)20-3/h4-11,15,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyFFXFVDMIZGKTOK-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.13
Rot. Bonds8

About 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide

2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide (PubChem CID 24554461) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide
PubChem CID24554461
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide
SMILESCNS(=O)(=O)Cc1ccccc1CNC(=O)C(C)Oc1cccc(C)c1
InChIInChI=1S/C19H24N2O4S/c1-14-7-6-10-18(11-14)25-15(2)19(22)21-12-16-8-4-5-9-17(16)13-26(23,24)20-3/h4-11,15,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyFFXFVDMIZGKTOK-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(hydroxymethyl)phenyl]methyl]-2-(3-methylphenoxy)propanamide
CID 110909100
2-(3-methylphenoxy)-N-(naphthalen-1-ylmethyl)propanamide
CID 133218956
N-[(2-chlorophenyl)methyl]-2-(3-methylphenoxy)propanamide
CID 6915501
(2R)-N-[(2-ethoxyphenyl)methyl]-2-(3-methylphenoxy)propanamide
CID 92679385
2-(3-methylphenoxy)-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]propanamide
CID 24563425
(2S)-N-[(3-methylphenyl)methyl]-2-phenoxypropanamide
CID 38295049
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(3-methylphenoxy)propanamide
CID 75455498
(2R)-2-(3,5-dimethylphenoxy)-N-[(3-methylphenyl)methyl]propanamide
CID 99132130
(2S)-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-2-(3-methylphenoxy)propanamide
CID 92675979
(2R)-N-[(2-methylphenyl)methyl]-2-phenoxypropanamide
CID 41013253
2-(3-methylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 21366996
dimethyl-[[4-[[[(2S)-2-(3-methylphenoxy)propanoyl]amino]methyl]phenyl]methyl]azanium
CID 9194529

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide?
The IUPAC name of 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide (CID 24554461) is 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide is CNS(=O)(=O)Cc1ccccc1CNC(=O)C(C)Oc1cccc(C)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide?
The InChIKey is FFXFVDMIZGKTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14-7-6-10-18(11-14)25-15(2)19(22)21-12-16-8-4-5-9-17(16)13-26(23,24)20-3/h4-11,15,20H,12-13H2,1-3H3,(H,21,22).
What are the key properties of 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide?
2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide has a molecular weight of 376.48 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-[[2-(methylsulfamoylmethyl)phenyl]methyl]propanamide is sourced from PubChem (CID 24554461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).