N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide

C19H18N4O5S — CID 54782946

IUPACN-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide
SMILESCOc1cc(NS(=O)(=O)c2ccc(NC(=O)COc3ccccc3)cc2)ncn1
InChIInChI=1S/C19H18N4O5S/c1-27-19-11-17(20-13-21-19)23-29(25,26)16-9-7-14(8-10-16)22-18(24)12-28-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3,(H,22,24)(H,20,21,23)
InChIKeyMSUGUMBWNIMPST-UHFFFAOYSA-N
MW414.44 g/mol
LogP2.30
Rot. Bonds8

About N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide

N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide (PubChem CID 54782946) has the molecular formula C19H18N4O5S and a molecular weight of 414.44 g/mol. Its IUPAC name is N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide
PubChem CID54782946
Molecular FormulaC19H18N4O5S
Molecular Weight414.44 g/mol
Exact Mass414.10
IUPAC NameN-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide
SMILESCOc1cc(NS(=O)(=O)c2ccc(NC(=O)COc3ccccc3)cc2)ncn1
InChIInChI=1S/C19H18N4O5S/c1-27-19-11-17(20-13-21-19)23-29(25,26)16-9-7-14(8-10-16)22-18(24)12-28-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3,(H,22,24)(H,20,21,23)
InChIKeyMSUGUMBWNIMPST-UHFFFAOYSA-N
XLogP2.30
TPSA119.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.44
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2,5-dimethylphenoxy)-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]acetamide
CID 54782870
2-(2,4-ditert-butylphenoxy)-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]acetamide
CID 54783172
2-phenylethyl 4-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]anilino]-4-oxobutanoate
CID 54782879
N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide
CID 987078
2-(4-methoxyphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide
CID 1078187
2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]acetamide
CID 5157338
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-phenoxyacetamide
CID 1116398
N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-4-propoxybenzamide
CID 5165415
N-[4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl]-2-phenoxyacetamide
CID 54782625
1-(3-chlorophenyl)-3-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]urea
CID 54782827
2-butoxy-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]benzamide
CID 54782829
4-chloro-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]benzamide
CID 3917847

Frequently Asked Questions

What is the IUPAC name of N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide (CID 54782946) is N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide is COc1cc(NS(=O)(=O)c2ccc(NC(=O)COc3ccccc3)cc2)ncn1.
What is the InChIKey of N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide?
The InChIKey is MSUGUMBWNIMPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O5S/c1-27-19-11-17(20-13-21-19)23-29(25,26)16-9-7-14(8-10-16)22-18(24)12-28-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3,(H,22,24)(H,20,21,23).
What are the key properties of N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide?
N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide has a molecular weight of 414.44 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 54782946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).