2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide

C12H12ClN3O5S — CID 100815540

IUPAC2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide
SMILESCc1cc(NS(=O)(=O)c2ccc(OCC(N)=O)c(Cl)c2)no1
InChIInChI=1S/C12H12ClN3O5S/c1-7-4-12(15-21-7)16-22(18,19)8-2-3-10(9(13)5-8)20-6-11(14)17/h2-5H,6H2,1H3,(H2,14,17)(H,15,16)
InChIKeyDZUXSOYYWAEATN-UHFFFAOYSA-N
MW345.76 g/mol
LogP1.30
Rot. Bonds6

About 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide

2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide (PubChem CID 100815540) has the molecular formula C12H12ClN3O5S and a molecular weight of 345.76 g/mol. Its IUPAC name is 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide
PubChem CID100815540
Molecular FormulaC12H12ClN3O5S
Molecular Weight345.76 g/mol
Exact Mass345.02
IUPAC Name2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide
SMILESCc1cc(NS(=O)(=O)c2ccc(OCC(N)=O)c(Cl)c2)no1
InChIInChI=1S/C12H12ClN3O5S/c1-7-4-12(15-21-7)16-22(18,19)8-2-3-10(9(13)5-8)20-6-11(14)17/h2-5H,6H2,1H3,(H2,14,17)(H,15,16)
InChIKeyDZUXSOYYWAEATN-UHFFFAOYSA-N
XLogP1.30
TPSA124.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.76
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3,4-diethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 9067995
CID 57350054
CID 57350054
2-(2-chloro-4-piperidin-1-ylsulfonylphenoxy)acetamide
CID 4667285
methyl 2-[2-chloro-4-[(3,4-dichlorophenyl)sulfamoyl]phenoxy]acetate
CID 2206278
5-bromo-6-chloro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-sulfonamide
CID 4729984
2-[2-chloro-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfamoyl]phenoxy]acetic acid
CID 167808293
4-(chloroamino)-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 162345507
2-[2-chloro-4-(4-methylpiperazin-1-yl)sulfonylphenoxy]acetamide
CID 100814466
4-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 670321
4-(2,2-difluoroethoxy)-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 75476941
3-chloro-4-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]ethyl]benzenesulfonamide
CID 110345150
2,5-dichloro-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 717534

Frequently Asked Questions

What is the IUPAC name of 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide?
The IUPAC name of 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide (CID 100815540) is 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide?
The canonical SMILES for 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide is Cc1cc(NS(=O)(=O)c2ccc(OCC(N)=O)c(Cl)c2)no1.
What is the InChIKey of 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide?
The InChIKey is DZUXSOYYWAEATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3O5S/c1-7-4-12(15-21-7)16-22(18,19)8-2-3-10(9(13)5-8)20-6-11(14)17/h2-5H,6H2,1H3,(H2,14,17)(H,15,16).
What are the key properties of 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide?
2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide has a molecular weight of 345.76 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloro-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenoxy]acetamide is sourced from PubChem (CID 100815540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).