N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide

C23H24N2O4S — CID 24609009

IUPACN-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide
SMILESCOc1cccc(CNC(=O)CN(c2ccccc2)S(=O)(=O)c2cccc(C)c2)c1
InChIInChI=1S/C23H24N2O4S/c1-18-8-6-13-22(14-18)30(27,28)25(20-10-4-3-5-11-20)17-23(26)24-16-19-9-7-12-21(15-19)29-2/h3-15H,16-17H2,1-2H3,(H,24,26)
InChIKeyAUQULIBTJSEFIV-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.52
Rot. Bonds8

About N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide

N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide (PubChem CID 24609009) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide
PubChem CID24609009
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide
SMILESCOc1cccc(CNC(=O)CN(c2ccccc2)S(=O)(=O)c2cccc(C)c2)c1
InChIInChI=1S/C23H24N2O4S/c1-18-8-6-13-22(14-18)30(27,28)25(20-10-4-3-5-11-20)17-23(26)24-16-19-9-7-12-21(15-19)29-2/h3-15H,16-17H2,1-2H3,(H,24,26)
InChIKeyAUQULIBTJSEFIV-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide
CID 26564448
2-(N-(4-chloro-3-nitrophenyl)sulfonylanilino)-N-[(3-methoxyphenyl)methyl]acetamide
CID 24605335
N-[(3-methoxyphenyl)methyl]-N-methyl-2-(N-(3-methylphenyl)sulfonylanilino)acetamide
CID 78881152
2-[N-(benzenesulfonyl)-3-methylanilino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 26565937
2-[N-(benzenesulfonyl)-3-methoxyanilino]-N-[[4-(dimethylamino)phenyl]methyl]acetamide
CID 53279043
2-(N-(4-methoxyphenyl)sulfonyl-4-methylanilino)-N-[(3-propan-2-yloxyphenyl)methyl]acetamide
CID 30228554
2-[N-(benzenesulfonyl)-4-ethoxyanilino]-N-[(3-ethoxyphenyl)methyl]acetamide
CID 30304403
2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 30176126
2-[N-(benzenesulfonyl)-3-methoxyanilino]-N-ethylacetamide
CID 3139093
2-[N-(benzenesulfonyl)-4-ethylanilino]-N-[(3-ethoxyphenyl)methyl]acetamide
CID 99950546
2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)-N-[(3-methoxyphenyl)methyl]acetamide
CID 53280506
2-[N-(benzenesulfonyl)-3-methoxyanilino]-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]acetamide
CID 30202029

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide (CID 24609009) is N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide is COc1cccc(CNC(=O)CN(c2ccccc2)S(=O)(=O)c2cccc(C)c2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide?
The InChIKey is AUQULIBTJSEFIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-18-8-6-13-22(14-18)30(27,28)25(20-10-4-3-5-11-20)17-23(26)24-16-19-9-7-12-21(15-19)29-2/h3-15H,16-17H2,1-2H3,(H,24,26).
What are the key properties of N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide?
N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide has a molecular weight of 424.52 g/mol, XLogP of 3.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-2-(N-(3-methylphenyl)sulfonylanilino)acetamide is sourced from PubChem (CID 24609009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).