N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide

C12H12N4O3S — CID 121014999

IUPACN-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccncn2)cc1
InChIInChI=1S/C12H12N4O3S/c1-9(17)15-10-2-4-11(5-3-10)20(18,19)16-12-6-7-13-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16)
InChIKeyXAJJMCKAIVZHHF-UHFFFAOYSA-N
MW292.32 g/mol
LogP1.24
Rot. Bonds4

About N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide

N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide (PubChem CID 121014999) has the molecular formula C12H12N4O3S and a molecular weight of 292.32 g/mol. Its IUPAC name is N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide
PubChem CID121014999
Molecular FormulaC12H12N4O3S
Molecular Weight292.32 g/mol
Exact Mass292.06
IUPAC NameN-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccncn2)cc1
InChIInChI=1S/C12H12N4O3S/c1-9(17)15-10-2-4-11(5-3-10)20(18,19)16-12-6-7-13-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16)
InChIKeyXAJJMCKAIVZHHF-UHFFFAOYSA-N
XLogP1.24
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(5-amino-2-pyridinyl)sulfamoyl]phenyl]acetamide
CID 43328729
formic acid;N-pyrimidin-4-ylbenzenesulfonamide
CID 139434719
N-pyrimidin-4-ylacetamide;hydrochloride
CID 126797028
N-[4-[(4-acetamidophenyl)sulfonylsulfamoyl]phenyl]acetamide
CID 71349024
N-[4-[[2-(methoxymethyl)-6-methylpyrimidin-4-yl]sulfamoyl]phenyl]acetamide
CID 163729231
N-[4-[(4-methoxypyrimidin-2-yl)sulfamoyl]phenyl]acetamide
CID 25048024
N-[4-[[5-(dipropylamino)-2-pyridinyl]sulfamoyl]phenyl]acetamide
CID 113030987
N-[4-[[2-(pyrimidin-4-ylamino)pyrimidin-4-yl]amino]phenyl]acetamide
CID 117086885
N-[4-[[4-(propan-2-ylamino)phenyl]sulfamoyl]phenyl]acetamide
CID 112979916
N-[4-[(2,3,4,5,6-pentafluorophenyl)sulfamoyl]phenyl]acetamide
CID 5193248
N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 725106
N-[3-[[6-(benzenesulfonamido)-3-pyridinyl]amino]phenyl]acetamide
CID 113035173

Frequently Asked Questions

What is the IUPAC name of N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide?
The IUPAC name of N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide (CID 121014999) is N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide?
The canonical SMILES for N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2ccncn2)cc1.
What is the InChIKey of N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide?
The InChIKey is XAJJMCKAIVZHHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O3S/c1-9(17)15-10-2-4-11(5-3-10)20(18,19)16-12-6-7-13-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16).
What are the key properties of N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide?
N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide has a molecular weight of 292.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(pyrimidin-4-ylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 121014999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).