N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide

C135H205N13O11S4 — CID 158400516

About N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide

N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide (PubChem CID 158400516) has the molecular formula C135H205N13O11S4 and a molecular weight of 2314.47 g/mol. Its IUPAC name is N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide.

Molecular Properties

• Compound Name: N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide
• PubChem CID: 158400516
• Molecular Formula: C135H205N13O11S4
• Molecular Weight: 2314.47 g/mol
• Exact Mass: 2312.48
• IUPAC Name: N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide
• SMILES: CC(=O)Nc1cccc(C(C)(C)C)c1C1CCCNC1.CC(C)(C)c1cccc(-c2cnc[nH]2)c1.CC(C)(C)c1cccc(-n2ccnc2)c1.CC(C)(C)c1cccc(C(=O)NCCCCCO)c1.CC(C)(C)c1ccccc1[C@@H]1CCCNC1.CC1CCCCN1S(=O)(=O)c1ccccc1C(C)(C)C.CC1CN(C)CCN1S(=O)(=O)c1ccccc1C(C)(C)C.CCCCN(C)S(=O)(=O)c1ccccc1C(C)(C)C.CCCN(C)S(=O)(=O)c1ccccc1C(C)(C)C
• InChI: InChI=1S/C17H26N2O.C16H26N2O2S.C16H25NO2S.C16H25NO2.C15H25NO2S.C15H23N.C14H23NO2S.2C13H16N2/c1-12(20)19-15-9-5-8-14(17(2,3)4)16(15)13-7-6-10-18-11-13;1-13-12-17(5)10-11-18(13)21(19,20)15-9-7-6-8-14(15)16(2,3)4;1-13-9-7-8-12-17(13)20(18,19)15-11-6-5-10-14(15)16(2,3)4;1-16(2,3)14-9-7-8-13(12-14)15(19)17-10-5-4-6-11-18;1-6-7-12-16(5)19(17,18)14-11-9-8-10-13(14)15(2,3)4;1-15(2,3)14-9-5-4-8-13(14)12-7-6-10-16-11-12;1-6-11-15(5)18(16,17)13-10-8-7-9-12(13)14(2,3)4;1-13(2,3)11-6-4-5-10(7-11)12-8-14-9-15-12;1-13(2,3)11-5-4-6-12(9-11)15-8-7-14-10-15/h5,8-9,13,18H,6-7,10-11H2,1-4H3,(H,19,20);6-9,13H,10-12H2,1-5H3;5-6,10-11,13H,7-9,12H2,1-4H3;7-9,12,18H,4-6,10-11H2,1-3H3,(H,17,19);8-11H,6-7,12H2,1-5H3;4-5,8-9,12,16H,6-7,10-11H2,1-3H3;7-10H,6,11H2,1-5H3;4-9H,1-3H3,(H,14,15);4-10H,1-3H3/t;;;;;12-;;;/m.....1.../s1
• InChIKey: GYAWMINUYCXHBK-RTCYPAROSA-N
• XLogP: 28.56
• TPSA: 301.75 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 17
• Rotatable Bonds: 24
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2314.47
LogP ≤ 5	28.56
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide?

The IUPAC name of N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide (CID 158400516) is N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide.

What is the SMILES notation for N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide?

The canonical SMILES for N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide is CC(=O)Nc1cccc(C(C)(C)C)c1C1CCCNC1.CC(C)(C)c1cccc(-c2cnc[nH]2)c1.CC(C)(C)c1cccc(-n2ccnc2)c1.CC(C)(C)c1cccc(C(=O)NCCCCCO)c1.CC(C)(C)c1ccccc1[C@@H]1CCCNC1.CC1CCCCN1S(=O)(=O)c1ccccc1C(C)(C)C.CC1CN(C)CCN1S(=O)(=O)c1ccccc1C(C)(C)C.CCCCN(C)S(=O)(=O)c1ccccc1C(C)(C)C.CCCN(C)S(=O)(=O)c1ccccc1C(C)(C)C.

What is the InChIKey of N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide?

The InChIKey is GYAWMINUYCXHBK-RTCYPAROSA-N. The full InChI is InChI=1S/C17H26N2O.C16H26N2O2S.C16H25NO2S.C16H25NO2.C15H25NO2S.C15H23N.C14H23NO2S.2C13H16N2/c1-12(20)19-15-9-5-8-14(17(2,3)4)16(15)13-7-6-10-18-11-13;1-13-12-17(5)10-11-18(13)21(19,20)15-9-7-6-8-14(15)16(2,3)4;1-13-9-7-8-12-17(13)20(18,19)15-11-6-5-10-14(15)16(2,3)4;1-16(2,3)14-9-7-8-13(12-14)15(19)17-10-5-4-6-11-18;1-6-7-12-16(5)19(17,18)14-11-9-8-10-13(14)15(2,3)4;1-15(2,3)14-9-5-4-8-13(14)12-7-6-10-16-11-12;1-6-11-15(5)18(16,17)13-10-8-7-9-12(13)14(2,3)4;1-13(2,3)11-6-4-5-10(7-11)12-8-14-9-15-12;1-13(2,3)11-5-4-6-12(9-11)15-8-7-14-10-15/h5,8-9,13,18H,6-7,10-11H2,1-4H3,(H,19,20);6-9,13H,10-12H2,1-5H3;5-6,10-11,13H,7-9,12H2,1-4H3;7-9,12,18H,4-6,10-11H2,1-3H3,(H,17,19);8-11H,6-7,12H2,1-5H3;4-5,8-9,12,16H,6-7,10-11H2,1-3H3;7-10H,6,11H2,1-5H3;4-9H,1-3H3,(H,14,15);4-10H,1-3H3/t;;;;;12-;;;/m.....1.../s1.

What are the key properties of N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide?

N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide has a molecular weight of 2314.47 g/mol, XLogP of 28.56, 24 rotatable bonds, 6 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for N-butyl-2-tert-butyl-N-methylbenzenesulfonamide;3-tert-butyl-N-(5-hydroxypentyl)benzamide;2-tert-butyl-N-methyl-N-propylbenzenesulfonamide;1-(3-tert-butylphenyl)imidazole;5-(3-tert-butylphenyl)-1H-imidazole;(3S)-3-(2-tert-butylphenyl)piperidine;1-(2-tert-butylphenyl)sulfonyl-2,4-dimethylpiperazine;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;N-(3-tert-butyl-2-piperidin-3-ylphenyl)acetamide is sourced from PubChem (CID 158400516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).