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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline

C105H160N10O8S3 — CID 158148019

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline (PubChem CID 158148019) has the molecular formula C105H160N10O8S3 and a molecular weight of 1786.70 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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline.

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline
• PubChem CID: 158148019
• Molecular Formula: C105H160N10O8S3
• Molecular Weight: 1786.70 g/mol
• Exact Mass: 1785.16
• 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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline
• SMILES: CC(C)(C)c1cccc(-c2cnc[nH]2)c1.CC(C)(C)c1cccc(-n2ccnc2)c1.CC(C)(C)c1cccc(C(=O)NCCCCCO)c1.CC(C)Nc1cccc(C(C)(C)C)c1C1CCCNC1.CC1CCCCN1S(=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/C18H30N2.C16H25NO2S.C16H25NO2.C15H25NO2S.C14H23NO2S.2C13H16N2/c1-13(2)20-16-10-6-9-15(18(3,4)5)17(16)14-8-7-11-19-12-14;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;1-6-11-15(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/h6,9-10,13-14,19-20H,7-8,11-12H2,1-5H3;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;7-10H,6,11H2,1-5H3;4-9H,1-3H3,(H,14,15);4-10H,1-3H3
• InChIKey: FUTHAUDVSVHRMR-UHFFFAOYSA-N
• XLogP: 23.66
• TPSA: 232.03 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 13
• Rotatable Bonds: 22
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1786.70
LogP ≤ 5	23.66
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	13

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline?

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline (CID 158148019) 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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline.

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline?

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline is CC(C)(C)c1cccc(-c2cnc[nH]2)c1.CC(C)(C)c1cccc(-n2ccnc2)c1.CC(C)(C)c1cccc(C(=O)NCCCCCO)c1.CC(C)Nc1cccc(C(C)(C)C)c1C1CCCNC1.CC1CCCCN1S(=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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline?

The InChIKey is FUTHAUDVSVHRMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2.C16H25NO2S.C16H25NO2.C15H25NO2S.C14H23NO2S.2C13H16N2/c1-13(2)20-16-10-6-9-15(18(3,4)5)17(16)14-8-7-11-19-12-14;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;1-6-11-15(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/h6,9-10,13-14,19-20H,7-8,11-12H2,1-5H3;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;7-10H,6,11H2,1-5H3;4-9H,1-3H3,(H,14,15);4-10H,1-3H3.

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline?

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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline has a molecular weight of 1786.70 g/mol, XLogP of 23.66, 22 rotatable bonds, 5 hydrogen bond donors, and 13 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;1-(2-tert-butylphenyl)sulfonyl-2-methylpiperidine;3-tert-butyl-2-piperidin-3-yl-N-propan-2-ylaniline is sourced from PubChem (CID 158148019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).