N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide

C122H167N15O18 — CID 159175234

About N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide

N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 159175234) has the molecular formula C122H167N15O18 and a molecular weight of 2131.76 g/mol. Its IUPAC name is N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

• Compound Name: N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide
• PubChem CID: 159175234
• Molecular Formula: C122H167N15O18
• Molecular Weight: 2131.76 g/mol
• Exact Mass: 2130.26
• IUPAC Name: N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide
• SMILES: CCOC(=O)N1CCC(NC(=O)c2ccc(C)cc2)CC1.COCCNC(=O)c1cccc(C)c1.Cc1ccc(C(=O)NCC2CCCO2)cc1.Cc1ccc(C(=O)NCC2COC(C)(C)O2)cc1.Cc1ccc(C(=O)NCCC2CCCN2C)cc1.Cc1ccc(C(=O)NCCCN2CCOCC2)cc1.Cc1ccc(C(=O)NCCCn2ccnc2)cc1.Cc1ccc(C(=O)NCCO)cc1.Cc1cccc(C(=O)NCCN2CCOCC2)c1
• InChI: InChI=1S/C16H22N2O3.C15H22N2O2.C15H22N2O.C14H17N3O.C14H20N2O2.C14H19NO3.C13H17NO2.C11H15NO2.C10H13NO2/c1-3-21-16(20)18-10-8-14(9-11-18)17-15(19)13-6-4-12(2)5-7-13;1-13-3-5-14(6-4-13)15(18)16-7-2-8-17-9-11-19-12-10-17;1-12-5-7-13(8-6-12)15(18)16-10-9-14-4-3-11-17(14)2;1-12-3-5-13(6-4-12)14(18)16-7-2-9-17-10-8-15-11-17;1-12-3-2-4-13(11-12)14(17)15-5-6-16-7-9-18-10-8-16;1-10-4-6-11(7-5-10)13(16)15-8-12-9-17-14(2,3)18-12;1-10-4-6-11(7-5-10)13(15)14-9-12-3-2-8-16-12;1-9-4-3-5-10(8-9)11(13)12-6-7-14-2;1-8-2-4-9(5-3-8)10(13)11-6-7-12/h4-7,14H,3,8-11H2,1-2H3,(H,17,19);3-6H,2,7-12H2,1H3,(H,16,18);5-8,14H,3-4,9-11H2,1-2H3,(H,16,18);3-6,8,10-11H,2,7,9H2,1H3,(H,16,18);2-4,11H,5-10H2,1H3,(H,15,17);4-7,12H,8-9H2,1-3H3,(H,15,16);4-7,12H,2-3,8-9H2,1H3,(H,14,15);3-5,8H,6-7H2,1-2H3,(H,12,13);2-5,12H,6-7H2,1H3,(H,11,13)
• InChIKey: KMEQFZBWZXFPCB-UHFFFAOYSA-N
• XLogP: 14.94
• TPSA: 394.59 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 23
• Rotatable Bonds: 34
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2131.76
LogP ≤ 5	14.94
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide?

The IUPAC name of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide (CID 159175234) is N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide.

What is the SMILES notation for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide?

The canonical SMILES for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide is CCOC(=O)N1CCC(NC(=O)c2ccc(C)cc2)CC1.COCCNC(=O)c1cccc(C)c1.Cc1ccc(C(=O)NCC2CCCO2)cc1.Cc1ccc(C(=O)NCC2COC(C)(C)O2)cc1.Cc1ccc(C(=O)NCCC2CCCN2C)cc1.Cc1ccc(C(=O)NCCCN2CCOCC2)cc1.Cc1ccc(C(=O)NCCCn2ccnc2)cc1.Cc1ccc(C(=O)NCCO)cc1.Cc1cccc(C(=O)NCCN2CCOCC2)c1.

What is the InChIKey of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide?

The InChIKey is KMEQFZBWZXFPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3.C15H22N2O2.C15H22N2O.C14H17N3O.C14H20N2O2.C14H19NO3.C13H17NO2.C11H15NO2.C10H13NO2/c1-3-21-16(20)18-10-8-14(9-11-18)17-15(19)13-6-4-12(2)5-7-13;1-13-3-5-14(6-4-13)15(18)16-7-2-8-17-9-11-19-12-10-17;1-12-5-7-13(8-6-12)15(18)16-10-9-14-4-3-11-17(14)2;1-12-3-5-13(6-4-12)14(18)16-7-2-9-17-10-8-15-11-17;1-12-3-2-4-13(11-12)14(17)15-5-6-16-7-9-18-10-8-16;1-10-4-6-11(7-5-10)13(16)15-8-12-9-17-14(2,3)18-12;1-10-4-6-11(7-5-10)13(15)14-9-12-3-2-8-16-12;1-9-4-3-5-10(8-9)11(13)12-6-7-14-2;1-8-2-4-9(5-3-8)10(13)11-6-7-12/h4-7,14H,3,8-11H2,1-2H3,(H,17,19);3-6H,2,7-12H2,1H3,(H,16,18);5-8,14H,3-4,9-11H2,1-2H3,(H,16,18);3-6,8,10-11H,2,7,9H2,1H3,(H,16,18);2-4,11H,5-10H2,1H3,(H,15,17);4-7,12H,8-9H2,1-3H3,(H,15,16);4-7,12H,2-3,8-9H2,1H3,(H,14,15);3-5,8H,6-7H2,1-2H3,(H,12,13);2-5,12H,6-7H2,1H3,(H,11,13).

What are the key properties of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide?

N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 2131.76 g/mol, XLogP of 14.94, 34 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 159175234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).