2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide

C88H92N12O15S4 — CID 161449496

IUPAC2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide
SMILESCOc1ccc(OC)c(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2cccc(C)c2)c1.COc1ccc(S(=O)(=O)N(CC(=O)Nc2cccnc2)c2cc(C)ccc2C)cc1.Cc1ccc(C)c(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2ccccc2C)c1.Cc1cccc(S(=O)(=O)N(CC(=O)Nc2cccnc2)c2cc(C)ccc2C)c1
InChIInChI=1S/C22H23N3O5S.C22H23N3O4S.2C22H23N3O3S/c1-16-6-4-8-19(12-16)31(27,28)25(15-22(26)24-17-7-5-11-23-14-17)20-13-18(29-2)9-10-21(20)30-3;1-16-6-7-17(2)21(13-16)25(15-22(26)24-18-5-4-12-23-14-18)30(27,28)20-10-8-19(29-3)9-11-20;1-16-6-4-8-20(12-16)29(27,28)25(21-13-17(2)9-10-18(21)3)15-22(26)24-19-7-5-11-23-14-19;1-16-10-11-17(2)20(13-16)25(15-22(26)24-19-8-6-12-23-14-19)29(27,28)21-9-5-4-7-18(21)3/h4-14H,15H2,1-3H3,(H,24,26);4-14H,15H2,1-3H3,(H,24,26);2*4-14H,15H2,1-3H3,(H,24,26)
InChIKeyWAIMTNSDZSDALY-UHFFFAOYSA-N
MW1686.04 g/mol
LogP14.46
Rot. Bonds27

About 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide

2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide (PubChem CID 161449496) has the molecular formula C88H92N12O15S4 and a molecular weight of 1686.04 g/mol. Its IUPAC name is 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide
PubChem CID161449496
Molecular FormulaC88H92N12O15S4
Molecular Weight1686.04 g/mol
Exact Mass1684.57
IUPAC Name2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide
SMILESCOc1ccc(OC)c(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2cccc(C)c2)c1.COc1ccc(S(=O)(=O)N(CC(=O)Nc2cccnc2)c2cc(C)ccc2C)cc1.Cc1ccc(C)c(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2ccccc2C)c1.Cc1cccc(S(=O)(=O)N(CC(=O)Nc2cccnc2)c2cc(C)ccc2C)c1
InChIInChI=1S/C22H23N3O5S.C22H23N3O4S.2C22H23N3O3S/c1-16-6-4-8-19(12-16)31(27,28)25(15-22(26)24-17-7-5-11-23-14-17)20-13-18(29-2)9-10-21(20)30-3;1-16-6-7-17(2)21(13-16)25(15-22(26)24-18-5-4-12-23-14-18)30(27,28)20-10-8-19(29-3)9-11-20;1-16-6-4-8-20(12-16)29(27,28)25(21-13-17(2)9-10-18(21)3)15-22(26)24-19-7-5-11-23-14-19;1-16-10-11-17(2)20(13-16)25(15-22(26)24-19-8-6-12-23-14-19)29(27,28)21-9-5-4-7-18(21)3/h4-14H,15H2,1-3H3,(H,24,26);4-14H,15H2,1-3H3,(H,24,26);2*4-14H,15H2,1-3H3,(H,24,26)
InChIKeyWAIMTNSDZSDALY-UHFFFAOYSA-N
XLogP14.46
TPSA345.17 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds27
Heavy Atoms119
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001686.04
LogP ≤ 514.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Analyze 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide with MolForge

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Related Compounds

2-(2,5-dimethoxy-N-(4-methoxyphenyl)sulfonylanilino)-N-pyridin-4-ylacetamide
CID 90051595
2-[N-(benzenesulfonyl)-5-chloro-2-methoxyanilino]-N-pyridin-3-ylacetamide
CID 1148684
2-[N-(benzenesulfonyl)-2-formyl-5-methoxyanilino]-N-pyridin-3-ylacetamide
CID 129225457
2-[N-(benzenesulfonyl)-2-methoxy-5-methylanilino]-N-(4-methylphenyl)acetamide
CID 30169948
2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-(3-methylphenyl)acetamide
CID 1372321
2-(5-chloro-N-(3,4-dimethoxyphenyl)sulfonyl-2-methoxyanilino)-N-pyridin-3-ylacetamide
CID 1000621
2-(2,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methylphenyl)acetamide
CID 30170588
N-(4-acetamidophenyl)-2-[N-(benzenesulfonyl)-2-methoxy-5-methylanilino]acetamide
CID 1210617
N-(3,4-dimethylphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 53280522
N-(3-chlorophenyl)-2-(2-methoxy-5-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 30172245
N-(3,5-dimethylphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 23911004
2-[N-(benzenesulfonyl)-5-chloro-2-methylanilino]-N-(3-methoxyphenyl)acetamide
CID 30170103

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide (CID 161449496) is 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide is COc1ccc(OC)c(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2cccc(C)c2)c1.COc1ccc(S(=O)(=O)N(CC(=O)Nc2cccnc2)c2cc(C)ccc2C)cc1.Cc1ccc(C)c(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2ccccc2C)c1.Cc1cccc(S(=O)(=O)N(CC(=O)Nc2cccnc2)c2cc(C)ccc2C)c1.
What is the InChIKey of 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide?
The InChIKey is WAIMTNSDZSDALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O5S.C22H23N3O4S.2C22H23N3O3S/c1-16-6-4-8-19(12-16)31(27,28)25(15-22(26)24-17-7-5-11-23-14-17)20-13-18(29-2)9-10-21(20)30-3;1-16-6-7-17(2)21(13-16)25(15-22(26)24-18-5-4-12-23-14-18)30(27,28)20-10-8-19(29-3)9-11-20;1-16-6-4-8-20(12-16)29(27,28)25(21-13-17(2)9-10-18(21)3)15-22(26)24-19-7-5-11-23-14-19;1-16-10-11-17(2)20(13-16)25(15-22(26)24-19-8-6-12-23-14-19)29(27,28)21-9-5-4-7-18(21)3/h4-14H,15H2,1-3H3,(H,24,26);4-14H,15H2,1-3H3,(H,24,26);2*4-14H,15H2,1-3H3,(H,24,26).
What are the key properties of 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide?
2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide has a molecular weight of 1686.04 g/mol, XLogP of 14.46, 27 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxy-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(2-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(2,5-dimethyl-N-(3-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide;2-(N-(4-methoxyphenyl)sulfonyl-2,5-dimethylanilino)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 161449496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).