N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide

C93H102N10O19S4 — CID 172986761

About N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide

N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide (PubChem CID 172986761) has the molecular formula C93H102N10O19S4 and a molecular weight of 1792.16 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide.

Molecular Properties

• Compound Name: N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide
• PubChem CID: 172986761
• Molecular Formula: C93H102N10O19S4
• Molecular Weight: 1792.16 g/mol
• Exact Mass: 1790.62
• IUPAC Name: N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide
• SMILES: CCc1ccc(N(CC(=O)N/N=C/c2cccnc2)S(=O)(=O)c2ccccc2)c(OC)c1.CCc1ccc(N(CC(=O)Nc2ccc(C(C)=O)cc2)S(=O)(=O)c2ccccc2)cc1.CCc1ccccc1NC(=O)CN(c1ccc(OC)cc1OC)S(=O)(=O)c1ccccc1.COc1ccc(S(=O)(=O)N(CC(=O)N2CCCCC2)c2cc(OC)ccc2OC)cc1
• InChI: InChI=1S/C24H26N2O5S.C24H24N2O4S.C23H24N4O4S.C22H28N2O6S/c1-4-18-10-8-9-13-21(18)25-24(27)17-26(32(28,29)20-11-6-5-7-12-20)22-15-14-19(30-2)16-23(22)31-3;1-3-19-9-15-22(16-10-19)26(31(29,30)23-7-5-4-6-8-23)17-24(28)25-21-13-11-20(12-14-21)18(2)27;1-3-18-11-12-21(22(14-18)31-2)27(32(29,30)20-9-5-4-6-10-20)17-23(28)26-25-16-19-8-7-13-24-15-19;1-28-17-7-10-19(11-8-17)31(26,27)24(16-22(25)23-13-5-4-6-14-23)20-15-18(29-2)9-12-21(20)30-3/h5-16H,4,17H2,1-3H3,(H,25,27);4-16H,3,17H2,1-2H3,(H,25,28);4-16H,3,17H2,1-2H3,(H,26,28);7-12,15H,4-6,13-14,16H2,1-3H3/b;;25-16+
• InChIKey: FLKRBHPSDKLQGM-UFLXZSEMSA-N
• XLogP: 14.30
• TPSA: 354.83 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 21
• Rotatable Bonds: 34
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1792.16
LogP ≤ 5	14.30
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide?

The IUPAC name of N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide (CID 172986761) is N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide.

What is the SMILES notation for N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide?

The canonical SMILES for N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide is CCc1ccc(N(CC(=O)N/N=C/c2cccnc2)S(=O)(=O)c2ccccc2)c(OC)c1.CCc1ccc(N(CC(=O)Nc2ccc(C(C)=O)cc2)S(=O)(=O)c2ccccc2)cc1.CCc1ccccc1NC(=O)CN(c1ccc(OC)cc1OC)S(=O)(=O)c1ccccc1.COc1ccc(S(=O)(=O)N(CC(=O)N2CCCCC2)c2cc(OC)ccc2OC)cc1.

What is the InChIKey of N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide?

The InChIKey is FLKRBHPSDKLQGM-UFLXZSEMSA-N. The full InChI is InChI=1S/C24H26N2O5S.C24H24N2O4S.C23H24N4O4S.C22H28N2O6S/c1-4-18-10-8-9-13-21(18)25-24(27)17-26(32(28,29)20-11-6-5-7-12-20)22-15-14-19(30-2)16-23(22)31-3;1-3-19-9-15-22(16-10-19)26(31(29,30)23-7-5-4-6-8-23)17-24(28)25-21-13-11-20(12-14-21)18(2)27;1-3-18-11-12-21(22(14-18)31-2)27(32(29,30)20-9-5-4-6-10-20)17-23(28)26-25-16-19-8-7-13-24-15-19;1-28-17-7-10-19(11-8-17)31(26,27)24(16-22(25)23-13-5-4-6-14-23)20-15-18(29-2)9-12-21(20)30-3/h5-16H,4,17H2,1-3H3,(H,25,27);4-16H,3,17H2,1-2H3,(H,25,28);4-16H,3,17H2,1-2H3,(H,26,28);7-12,15H,4-6,13-14,16H2,1-3H3/b;;25-16+;.

What are the key properties of N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide?

N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide has a molecular weight of 1792.16 g/mol, XLogP of 14.30, 34 rotatable bonds, 3 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-acetylphenyl)-2-[N-(benzenesulfonyl)-4-ethylanilino]acetamide;2-[N-(benzenesulfonyl)-2,4-dimethoxyanilino]-N-(2-ethylphenyl)acetamide;2-[N-(benzenesulfonyl)-4-ethyl-2-methoxyanilino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide;N-(2,5-dimethoxyphenyl)-4-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide is sourced from PubChem (CID 172986761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).