3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide

C14H22N2O5S — CID 92517191

IUPAC3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide
SMILESCOC[C@@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C14H22N2O5S/c1-10(9-20-4)15-14(17)11-6-7-12(21-5)13(8-11)22(18,19)16(2)3/h6-8,10H,9H2,1-5H3,(H,15,17)/t10-/m1/s1
InChIKeyYHDRBNUHZGGSAV-SNVBAGLBSA-N
MW330.41 g/mol
LogP0.71
Rot. Bonds7

About 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide

3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide (PubChem CID 92517191) has the molecular formula C14H22N2O5S and a molecular weight of 330.41 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide
PubChem CID92517191
Molecular FormulaC14H22N2O5S
Molecular Weight330.41 g/mol
Exact Mass330.12
IUPAC Name3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide
SMILESCOC[C@@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C14H22N2O5S/c1-10(9-20-4)15-14(17)11-6-7-12(21-5)13(8-11)22(18,19)16(2)3/h6-8,10H,9H2,1-5H3,(H,15,17)/t10-/m1/s1
InChIKeyYHDRBNUHZGGSAV-SNVBAGLBSA-N
XLogP0.71
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide (CID 92517191) is 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide is COC[C@@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide?
The InChIKey is YHDRBNUHZGGSAV-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H22N2O5S/c1-10(9-20-4)15-14(17)11-6-7-12(21-5)13(8-11)22(18,19)16(2)3/h6-8,10H,9H2,1-5H3,(H,15,17)/t10-/m1/s1.
What are the key properties of 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide?
3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide has a molecular weight of 330.41 g/mol, XLogP of 0.71, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide is sourced from PubChem (CID 92517191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).