2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide

C19H19N3O4S — CID 18572074

IUPAC2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide
SMILESCOc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3ccccc3)n2C)cc1
InChIInChI=1S/C19H19N3O4S/c1-22-17(14-8-10-16(26-2)11-9-14)12-20-19(22)27(24,25)13-18(23)21-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H,21,23)
InChIKeyRCIVPZKNOJFDHZ-UHFFFAOYSA-N
MW385.45 g/mol
LogP2.51
Rot. Bonds6

About 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide

2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide (PubChem CID 18572074) has the molecular formula C19H19N3O4S and a molecular weight of 385.45 g/mol. Its IUPAC name is 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide
PubChem CID18572074
Molecular FormulaC19H19N3O4S
Molecular Weight385.45 g/mol
Exact Mass385.11
IUPAC Name2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide
SMILESCOc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3ccccc3)n2C)cc1
InChIInChI=1S/C19H19N3O4S/c1-22-17(14-8-10-16(26-2)11-9-14)12-20-19(22)27(24,25)13-18(23)21-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H,21,23)
InChIKeyRCIVPZKNOJFDHZ-UHFFFAOYSA-N
XLogP2.51
TPSA90.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.45
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-methoxyphenyl)sulfonyl-N-phenylacetamide
CID 15451751
2-[1-(4-fluorophenyl)-4-(4-methoxyphenyl)imidazol-2-yl]sulfonyl-N-phenylacetamide
CID 22423019
N-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]benzamide
CID 1096852
N'-(4-methoxyphenyl)-N-phenylpropanediamide
CID 15154641
2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]acetamide
CID 18569191
N-(3,5-dimethylphenyl)-2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfanylacetamide
CID 18569187
2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfanyl-N-(4-nitrophenyl)acetamide
CID 40692341
2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 1486366
N-benzyl-2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfinylacetamide
CID 18572067
2-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 27449078
2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 20969537
5-(4-methoxyphenyl)-1-methylimidazole-2-carbaldehyde
CID 84681714

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide?
The IUPAC name of 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide (CID 18572074) is 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide.
What is the SMILES notation for 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide?
The canonical SMILES for 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide is COc1ccc(-c2cnc(S(=O)(=O)CC(=O)Nc3ccccc3)n2C)cc1.
What is the InChIKey of 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide?
The InChIKey is RCIVPZKNOJFDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4S/c1-22-17(14-8-10-16(26-2)11-9-14)12-20-19(22)27(24,25)13-18(23)21-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H,21,23).
What are the key properties of 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide?
2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide has a molecular weight of 385.45 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]sulfonyl-N-phenylacetamide is sourced from PubChem (CID 18572074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).