N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide

C24H25NO4S — CID 19218394

IUPACN-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide
SMILESCc1ccc(S(=O)(=O)N(C(=O)COc2c(C)ccc(C)c2C)c2ccccc2)cc1
InChIInChI=1S/C24H25NO4S/c1-17-10-14-22(15-11-17)30(27,28)25(21-8-6-5-7-9-21)23(26)16-29-24-19(3)13-12-18(2)20(24)4/h5-15H,16H2,1-4H3
InChIKeyAUPLCAROWXTHBE-UHFFFAOYSA-N
MW423.53 g/mol
LogP4.72
Rot. Bonds6

About N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide

N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide (PubChem CID 19218394) has the molecular formula C24H25NO4S and a molecular weight of 423.53 g/mol. Its IUPAC name is N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide
PubChem CID19218394
Molecular FormulaC24H25NO4S
Molecular Weight423.53 g/mol
Exact Mass423.15
IUPAC NameN-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide
SMILESCc1ccc(S(=O)(=O)N(C(=O)COc2c(C)ccc(C)c2C)c2ccccc2)cc1
InChIInChI=1S/C24H25NO4S/c1-17-10-14-22(15-11-17)30(27,28)25(21-8-6-5-7-9-21)23(26)16-29-24-19(3)13-12-18(2)20(24)4/h5-15H,16H2,1-4H3
InChIKeyAUPLCAROWXTHBE-UHFFFAOYSA-N
XLogP4.72
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.53
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(benzenesulfonyl)-2-(2,6-dimethylphenoxy)-N-phenylacetamide
CID 19217816
N-(4-butylphenyl)-N-(4-methylphenyl)sulfonyl-2-(2,3,6-trimethylphenoxy)acetamide
CID 19218406
2-(2-methoxyphenoxy)-N-(4-methylphenyl)sulfonyl-N-phenylacetamide
CID 19217917
N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-phenoxyacetamide
CID 19212618
2-(2,6-dimethylphenoxy)-N-(2,3-dimethylphenyl)-N-(4-methylphenyl)sulfonylacetamide
CID 19217830
N-(benzenesulfonyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 19212675
2-(2-methoxyphenoxy)-N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylacetamide
CID 1283700
N-(benzenesulfonyl)-2-(3,5-dimethylphenoxy)-N-(4-methylphenyl)acetamide
CID 19217513
2-(2,4-dimethylphenoxy)-N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylacetamide
CID 19218121
N-(4-ethoxyphenyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)sulfonylacetamide
CID 19212681
4-(4-methylphenoxy)-N-(4-methylphenyl)sulfonyl-N-phenylbutanamide
CID 19218749
3,3-dimethyl-N-(4-methylphenyl)sulfonyl-N-phenylbutanamide
CID 19219305

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide?
The IUPAC name of N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide (CID 19218394) is N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide.
What is the SMILES notation for N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide?
The canonical SMILES for N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide is Cc1ccc(S(=O)(=O)N(C(=O)COc2c(C)ccc(C)c2C)c2ccccc2)cc1.
What is the InChIKey of N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide?
The InChIKey is AUPLCAROWXTHBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO4S/c1-17-10-14-22(15-11-17)30(27,28)25(21-8-6-5-7-9-21)23(26)16-29-24-19(3)13-12-18(2)20(24)4/h5-15H,16H2,1-4H3.
What are the key properties of N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide?
N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide has a molecular weight of 423.53 g/mol, XLogP of 4.72, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)sulfonyl-N-phenyl-2-(2,3,6-trimethylphenoxy)acetamide is sourced from PubChem (CID 19218394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).