N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide

C15H16N4O4S — CID 86734626

IUPACN-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(C3CC3)c(=O)n2)cc1
InChIInChI=1S/C15H16N4O4S/c1-10(20)16-11-2-6-13(7-3-11)24(22,23)18-14-8-9-19(12-4-5-12)15(21)17-14/h2-3,6-9,12H,4-5H2,1H3,(H,16,20)(H,17,18,21)
InChIKeyWGLAQCOYPXHGLA-UHFFFAOYSA-N
MW348.38 g/mol
LogP1.34
Rot. Bonds5

About N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide

N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide (PubChem CID 86734626) has the molecular formula C15H16N4O4S and a molecular weight of 348.38 g/mol. Its IUPAC name is N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide
PubChem CID86734626
Molecular FormulaC15H16N4O4S
Molecular Weight348.38 g/mol
Exact Mass348.09
IUPAC NameN-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(C3CC3)c(=O)n2)cc1
InChIInChI=1S/C15H16N4O4S/c1-10(20)16-11-2-6-13(7-3-11)24(22,23)18-14-8-9-19(12-4-5-12)15(21)17-14/h2-3,6-9,12H,4-5H2,1H3,(H,16,20)(H,17,18,21)
InChIKeyWGLAQCOYPXHGLA-UHFFFAOYSA-N
XLogP1.34
TPSA110.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.38
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[(4-bromocyclohexyl)sulfamoyl]phenyl]acetamide
CID 114295839
N-[4-[[4-(cyclopentylamino)phenyl]sulfamoyl]phenyl]acetamide
CID 112980678
N-[4-[[(1S,2S)-2-hydroxycyclohexyl]sulfamoyl]phenyl]acetamide
CID 27059218
N-[4-[[4-(4-cyclobutylpiperazine-1-carbonyl)cyclohexyl]sulfamoyl]phenyl]acetamide
CID 67394155
N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide
CID 121014999
N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390
N-[4-[[(3R)-piperidin-3-yl]sulfamoyl]phenyl]acetamide
CID 104645741
N-[4-[[1-[(4-methylphenyl)methyl]pyrazol-3-yl]sulfamoyl]phenyl]acetamide
CID 22201934
N-[4-[(4-acetamidophenyl)sulfonylsulfamoyl]phenyl]acetamide
CID 71349024
2-amino-N-[4-[[1-[4-(4-aminopiperidin-1-yl)butyl]-2-oxopyrimidin-4-yl]sulfamoyl]phenyl]-3-hydroxy-2-methylpropanamide
CID 137415433
(2S)-2-amino-N-[4-[[1-[4-(4-aminopiperidin-1-yl)butyl]-2-oxopyrimidin-4-yl]sulfamoyl]phenyl]-3-hydroxy-2-methylpropanamide
CID 142516129
N-[4-[(5-amino-2-pyridinyl)sulfamoyl]phenyl]acetamide
CID 43328729

Frequently Asked Questions

What is the IUPAC name of N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide (CID 86734626) is N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(C3CC3)c(=O)n2)cc1.
What is the InChIKey of N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is WGLAQCOYPXHGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O4S/c1-10(20)16-11-2-6-13(7-3-11)24(22,23)18-14-8-9-19(12-4-5-12)15(21)17-14/h2-3,6-9,12H,4-5H2,1H3,(H,16,20)(H,17,18,21).
What are the key properties of N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide?
N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 348.38 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 86734626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).