N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide

C23H24N2O4S — CID 30262141

IUPACN-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
SMILESCCc1ccc(NC(=O)CN(c2ccccc2Oc2ccccc2)S(C)(=O)=O)cc1
InChIInChI=1S/C23H24N2O4S/c1-3-18-13-15-19(16-14-18)24-23(26)17-25(30(2,27)28)21-11-7-8-12-22(21)29-20-9-5-4-6-10-20/h4-16H,3,17H2,1-2H3,(H,24,26)
InChIKeyRVURGKZFZFWMAI-UHFFFAOYSA-N
MW424.52 g/mol
LogP4.45
Rot. Bonds8

About N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide

N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide (PubChem CID 30262141) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
PubChem CID30262141
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
SMILESCCc1ccc(NC(=O)CN(c2ccccc2Oc2ccccc2)S(C)(=O)=O)cc1
InChIInChI=1S/C23H24N2O4S/c1-3-18-13-15-19(16-14-18)24-23(26)17-25(30(2,27)28)21-11-7-8-12-22(21)29-20-9-5-4-6-10-20/h4-16H,3,17H2,1-2H3,(H,24,26)
InChIKeyRVURGKZFZFWMAI-UHFFFAOYSA-N
XLogP4.45
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-iodophenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
CID 43899457
N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-propan-2-yloxyanilino)acetamide
CID 113155378
2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide
CID 113154121
N-ethyl-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
CID 30255339
2-(2-methyl-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide
CID 8574795
N-(2-ethyl-6-methylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
CID 30268858
2-(2-chloro-N-methylsulfonylanilino)-N-(4-phenoxyphenyl)acetamide
CID 1363234
2-(4-ethyl-N-methylsulfonylanilino)-N-phenylacetamide
CID 951908
2-(2-methoxy-N-methylsulfonylanilino)-N-(4-methoxyphenyl)acetamide
CID 1334036
2-[[2-(N-methylsulfonyl-2-phenoxyanilino)acetyl]amino]benzamide
CID 30276893
2-(N-methylsulfonyl-2-phenoxyanilino)-N-(2-phenylphenyl)acetamide
CID 30271434
N-(2-ethylsulfanylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
CID 30275443

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide?
The IUPAC name of N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide (CID 30262141) is N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide is CCc1ccc(NC(=O)CN(c2ccccc2Oc2ccccc2)S(C)(=O)=O)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide?
The InChIKey is RVURGKZFZFWMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-3-18-13-15-19(16-14-18)24-23(26)17-25(30(2,27)28)21-11-7-8-12-22(21)29-20-9-5-4-6-10-20/h4-16H,3,17H2,1-2H3,(H,24,26).
What are the key properties of N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide?
N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide has a molecular weight of 424.52 g/mol, XLogP of 4.45, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide is sourced from PubChem (CID 30262141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).