4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine

C124H170N26O15S6 — CID 90869164

About 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine

4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine (PubChem CID 90869164) has the molecular formula C124H170N26O15S6 and a molecular weight of 2457.29 g/mol. Its IUPAC name is 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

• Compound Name: 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine
• PubChem CID: 90869164
• Molecular Formula: C124H170N26O15S6
• Molecular Weight: 2457.29 g/mol
• Exact Mass: 2455.17
• IUPAC Name: 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine
• SMILES: CCC(COCCC1CCN(S(=O)(=O)C(C)C)CC1)n1cnc2c(N)nc3ccccc3c21.CCC(COCCC1CCN(S(=O)(=O)N(C)C)CC1)n1cnc2c(N)nc3ccccc3c21.CCC(COCCC1CCN(S(=O)(=O)c2ccccc2)CC1)n1cnc2c(N)nc3ccccc3c21.CCC(COCCC1CCN(S(=O)(=O)c2cccs2)CC1)n1cnc2c(N)nc3ccccc3c21.CCCCS(=O)(=O)N1CCC(CCOCC(CC)n2cnc3c(N)nc4ccccc4c32)CC1
• InChI: InChI=1S/C27H33N5O3S.C25H31N5O3S2.C25H37N5O3S.C24H35N5O3S.C23H34N6O3S/c1-2-21(32-19-29-25-26(32)23-10-6-7-11-24(23)30-27(25)28)18-35-17-14-20-12-15-31(16-13-20)36(33,34)22-8-4-3-5-9-22;1-2-19(30-17-27-23-24(30)20-6-3-4-7-21(20)28-25(23)26)16-33-14-11-18-9-12-29(13-10-18)35(31,32)22-8-5-15-34-22;1-3-5-16-34(31,32)29-13-10-19(11-14-29)12-15-33-17-20(4-2)30-18-27-23-24(30)21-8-6-7-9-22(21)28-25(23)26;1-4-19(15-32-14-11-18-9-12-28(13-10-18)33(30,31)17(2)3)29-16-26-22-23(29)20-7-5-6-8-21(20)27-24(22)25;1-4-18(15-32-14-11-17-9-12-28(13-10-17)33(30,31)27(2)3)29-16-25-21-22(29)19-7-5-6-8-20(19)26-23(21)24/h3-11,19-21H,2,12-18H2,1H3,(H2,28,30);3-8,15,17-19H,2,9-14,16H2,1H3,(H2,26,28);6-9,18-20H,3-5,10-17H2,1-2H3,(H2,26,28);5-8,16-19H,4,9-15H2,1-3H3,(H2,25,27);5-8,16-18H,4,9-15H2,1-3H3,(H2,24,26)
• InChIKey: KTWRBGAASFUHQK-UHFFFAOYSA-N
• XLogP: 20.70
• TPSA: 519.94 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 36
• Rotatable Bonds: 47
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2457.29
LogP ≤ 5	20.70
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine?

The IUPAC name of 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine (CID 90869164) is 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine.

What is the SMILES notation for 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine?

The canonical SMILES for 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine is CCC(COCCC1CCN(S(=O)(=O)C(C)C)CC1)n1cnc2c(N)nc3ccccc3c21.CCC(COCCC1CCN(S(=O)(=O)N(C)C)CC1)n1cnc2c(N)nc3ccccc3c21.CCC(COCCC1CCN(S(=O)(=O)c2ccccc2)CC1)n1cnc2c(N)nc3ccccc3c21.CCC(COCCC1CCN(S(=O)(=O)c2cccs2)CC1)n1cnc2c(N)nc3ccccc3c21.CCCCS(=O)(=O)N1CCC(CCOCC(CC)n2cnc3c(N)nc4ccccc4c32)CC1.

What is the InChIKey of 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine?

The InChIKey is KTWRBGAASFUHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N5O3S.C25H31N5O3S2.C25H37N5O3S.C24H35N5O3S.C23H34N6O3S/c1-2-21(32-19-29-25-26(32)23-10-6-7-11-24(23)30-27(25)28)18-35-17-14-20-12-15-31(16-13-20)36(33,34)22-8-4-3-5-9-22;1-2-19(30-17-27-23-24(30)20-6-3-4-7-21(20)28-25(23)26)16-33-14-11-18-9-12-29(13-10-18)35(31,32)22-8-5-15-34-22;1-3-5-16-34(31,32)29-13-10-19(11-14-29)12-15-33-17-20(4-2)30-18-27-23-24(30)21-8-6-7-9-22(21)28-25(23)26;1-4-19(15-32-14-11-18-9-12-28(13-10-18)33(30,31)17(2)3)29-16-26-22-23(29)20-7-5-6-8-21(20)27-24(22)25;1-4-18(15-32-14-11-17-9-12-28(13-10-17)33(30,31)27(2)3)29-16-25-21-22(29)19-7-5-6-8-20(19)26-23(21)24/h3-11,19-21H,2,12-18H2,1H3,(H2,28,30);3-8,15,17-19H,2,9-14,16H2,1H3,(H2,26,28);6-9,18-20H,3-5,10-17H2,1-2H3,(H2,26,28);5-8,16-19H,4,9-15H2,1-3H3,(H2,25,27);5-8,16-18H,4,9-15H2,1-3H3,(H2,24,26).

What are the key properties of 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine?

4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine has a molecular weight of 2457.29 g/mol, XLogP of 20.70, 47 rotatable bonds, 5 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)butoxy]ethyl]-N,N-dimethylpiperidine-1-sulfonamide;1-[1-[2-[1-(benzenesulfonyl)piperidin-4-yl]ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-butylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-propan-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine;1-[1-[2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)ethoxy]butan-2-yl]imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 90869164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).