2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide

C14H14ClN3O4S — CID 992277

IUPAC2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide
SMILESCc1cc(Cl)c(S(=O)(=O)Nc2ccccn2)cc1OCC(N)=O
InChIInChI=1S/C14H14ClN3O4S/c1-9-6-10(15)12(7-11(9)22-8-13(16)19)23(20,21)18-14-4-2-3-5-17-14/h2-7H,8H2,1H3,(H2,16,19)(H,17,18)
InChIKeyKCMVDXWJEYEPFA-UHFFFAOYSA-N
MW355.80 g/mol
LogP1.71
Rot. Bonds6

About 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide

2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide (PubChem CID 992277) has the molecular formula C14H14ClN3O4S and a molecular weight of 355.80 g/mol. Its IUPAC name is 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide
PubChem CID992277
Molecular FormulaC14H14ClN3O4S
Molecular Weight355.80 g/mol
Exact Mass355.04
IUPAC Name2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide
SMILESCc1cc(Cl)c(S(=O)(=O)Nc2ccccn2)cc1OCC(N)=O
InChIInChI=1S/C14H14ClN3O4S/c1-9-6-10(15)12(7-11(9)22-8-13(16)19)23(20,21)18-14-4-2-3-5-17-14/h2-7H,8H2,1H3,(H2,16,19)(H,17,18)
InChIKeyKCMVDXWJEYEPFA-UHFFFAOYSA-N
XLogP1.71
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.80
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-chloro-2-methyl-5-(phenylsulfamoyl)phenoxy]acetamide
CID 992279
2-[4-chloro-2-methyl-5-[(4-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 992284
2,4-dimethyl-5-propoxy-N-pyridin-2-ylbenzenesulfonamide
CID 15943748
4-[[[5-(2-amino-2-oxoethoxy)-2-chloro-4-methylphenyl]sulfonylamino]methyl]benzoate
CID 2200833
2,5-dimethyl-4-propoxy-N-pyridin-2-ylbenzenesulfonamide
CID 2991807
2-(4-chloro-2-methyl-5-piperidin-1-ylsulfonylphenoxy)acetamide
CID 976547
4-bromo-5-methoxy-2-methyl-N-pyridin-2-ylbenzenesulfonamide
CID 16644702
3-methyl-4-(pyridin-2-ylsulfamoyl)benzenecarbothioamide
CID 106997501
4-ethoxy-2-methyl-5-propan-2-yl-N-pyridin-2-ylbenzenesulfonamide
CID 2986731
4-(aminomethyl)-2-methyl-N-pyridin-2-ylbenzenesulfonamide
CID 106996553
2-[4-chloro-2-methyl-5-(1,2-oxazol-3-ylsulfamoyl)phenoxy]-N-cyclohexylacetamide
CID 2204065
2,3,4,5-tetramethyl-N-pyridin-2-ylbenzenesulfonamide
CID 16644704

Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide?
The IUPAC name of 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide (CID 992277) is 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide is Cc1cc(Cl)c(S(=O)(=O)Nc2ccccn2)cc1OCC(N)=O.
What is the InChIKey of 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide?
The InChIKey is KCMVDXWJEYEPFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O4S/c1-9-6-10(15)12(7-11(9)22-8-13(16)19)23(20,21)18-14-4-2-3-5-17-14/h2-7H,8H2,1H3,(H2,16,19)(H,17,18).
What are the key properties of 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide?
2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide has a molecular weight of 355.80 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-2-methyl-5-(pyridin-2-ylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 992277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).