2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide

C14H18N4O5S — CID 74925297

IUPAC2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide
SMILESCC1NC(=O)NC(=O)C1CC(=O)NCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C14H18N4O5S/c1-8-11(13(20)18-14(21)17-8)6-12(19)16-7-9-2-4-10(5-3-9)24(15,22)23/h2-5,8,11H,6-7H2,1H3,(H,16,19)(H2,15,22,23)(H2,17,18,20,21)
InChIKeyIFNOCERKEHEZAU-UHFFFAOYSA-N
MW354.39 g/mol
LogP-0.82
Rot. Bonds5

About 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide

2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide (PubChem CID 74925297) has the molecular formula C14H18N4O5S and a molecular weight of 354.39 g/mol. Its IUPAC name is 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide
PubChem CID74925297
Molecular FormulaC14H18N4O5S
Molecular Weight354.39 g/mol
Exact Mass354.10
IUPAC Name2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide
SMILESCC1NC(=O)NC(=O)C1CC(=O)NCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C14H18N4O5S/c1-8-11(13(20)18-14(21)17-8)6-12(19)16-7-9-2-4-10(5-3-9)24(15,22)23/h2-5,8,11H,6-7H2,1H3,(H,16,19)(H2,15,22,23)(H2,17,18,20,21)
InChIKeyIFNOCERKEHEZAU-UHFFFAOYSA-N
XLogP-0.82
TPSA147.46 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.39
LogP ≤ 5-0.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-chlorophenyl)methyl]-2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)acetamide
CID 74925233
2-[2,5-dioxo-1-(2-phenylethyl)imidazolidin-4-yl]-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 86207041
2-(1-propan-2-ylpiperidin-4-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 50968872
1-ethyl-3-[(4-sulfamoylphenyl)methyl]urea
CID 24685233
3-[(3S)-2,5-dioxo-3,4-dihydro-1H-1,4-benzodiazepin-3-yl]-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 71825786
N-[(4-sulfamoylphenyl)methyl]pentanamide
CID 4162938
2-(prop-2-ynylamino)-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 78909532
6-amino-N-[(4-sulfamoylphenyl)methyl]hexanamide
CID 24689884
N-[(4-sulfamoylphenyl)methyl]hexanamide
CID 3562284
2-amino-N-[2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl]acetamide
CID 10756624
N-[(4-sulfamoylphenyl)methyl]heptanamide
CID 4072326
3-cyclohexyl-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 2431253

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide (CID 74925297) is 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide is CC1NC(=O)NC(=O)C1CC(=O)NCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide?
The InChIKey is IFNOCERKEHEZAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O5S/c1-8-11(13(20)18-14(21)17-8)6-12(19)16-7-9-2-4-10(5-3-9)24(15,22)23/h2-5,8,11H,6-7H2,1H3,(H,16,19)(H2,15,22,23)(H2,17,18,20,21).
What are the key properties of 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide?
2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide has a molecular weight of 354.39 g/mol, XLogP of -0.82, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2,6-dioxo-1,3-diazinan-5-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide is sourced from PubChem (CID 74925297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).