7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine

C122H157N29O12 — CID 161010510

About 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine

7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine (PubChem CID 161010510) has the molecular formula C122H157N29O12 and a molecular weight of 2221.79 g/mol. Its IUPAC name is 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine.

Molecular Properties

• Compound Name: 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine
• PubChem CID: 161010510
• Molecular Formula: C122H157N29O12
• Molecular Weight: 2221.79 g/mol
• Exact Mass: 2220.26
• IUPAC Name: 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine
• SMILES: CC(C)CCOc1cccc2nc(N)c3nn(CCC(C)C)cc3c12.CC(C)CCn1cc2c(n1)c(N)nc1cccc(O)c12.CCCCn1cc2c(n1)c(N)nc1cccc(OCCC(C)C)c12.CCOCc1nc2c(N)nc3cccc(OCCCCCC(C)=O)c3c2n1C.CCOCc1nc2c(N)nc3cccc(OCCCN)c3c2n1C.CCOCc1nc2c(N)nc3cccc(OCCCNC(C)=O)c3c2n1C.Nc1nc2cccc(O)c2c2c1=NCC=2
• InChI: InChI=1S/C21H28N4O3.C20H28N4O.C19H25N5O3.C19H26N4O.C17H23N5O2.C15H18N4O.C11H9N3O/c1-4-27-13-17-24-19-20(25(17)3)18-15(23-21(19)22)10-8-11-16(18)28-12-7-5-6-9-14(2)26;1-13(2)8-10-24-12-15-18-16(22-20(21)19(15)23-24)6-5-7-17(18)25-11-9-14(3)4;1-4-26-11-15-23-17-18(24(15)3)16-13(22-19(17)20)7-5-8-14(16)27-10-6-9-21-12(2)25;1-4-5-10-23-12-14-17-15(21-19(20)18(14)22-23)7-6-8-16(17)24-11-9-13(2)3;1-3-23-10-13-21-15-16(22(13)2)14-11(20-17(15)19)6-4-7-12(14)24-9-5-8-18;1-9(2)6-7-19-8-10-13-11(4-3-5-12(13)20)17-15(16)14(10)18-19;12-11-10-6(4-5-13-10)9-7(14-11)2-1-3-8(9)15/h8,10-11H,4-7,9,12-13H2,1-3H3,(H2,22,23);5-7,12-14H,8-11H2,1-4H3,(H2,21,22);5,7-8H,4,6,9-11H2,1-3H3,(H2,20,22)(H,21,25);6-8,12-13H,4-5,9-11H2,1-3H3,(H2,20,21);4,6-7H,3,5,8-10,18H2,1-2H3,(H2,19,20);3-5,8-9,20H,6-7H2,1-2H3,(H2,16,17);1-4,15H,5H2,(H2,12,14)
• InChIKey: TXBKAEPQNQPCIV-UHFFFAOYSA-N
• XLogP: 19.77
• TPSA: 578.14 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 40
• Rotatable Bonds: 42
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2221.79
LogP ≤ 5	19.77
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine?

The IUPAC name of 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine (CID 161010510) is 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine.

What is the SMILES notation for 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine?

The canonical SMILES for 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine is CC(C)CCOc1cccc2nc(N)c3nn(CCC(C)C)cc3c12.CC(C)CCn1cc2c(n1)c(N)nc1cccc(O)c12.CCCCn1cc2c(n1)c(N)nc1cccc(OCCC(C)C)c12.CCOCc1nc2c(N)nc3cccc(OCCCCCC(C)=O)c3c2n1C.CCOCc1nc2c(N)nc3cccc(OCCCN)c3c2n1C.CCOCc1nc2c(N)nc3cccc(OCCCNC(C)=O)c3c2n1C.Nc1nc2cccc(O)c2c2c1=NCC=2.

What is the InChIKey of 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine?

The InChIKey is TXBKAEPQNQPCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O3.C20H28N4O.C19H25N5O3.C19H26N4O.C17H23N5O2.C15H18N4O.C11H9N3O/c1-4-27-13-17-24-19-20(25(17)3)18-15(23-21(19)22)10-8-11-16(18)28-12-7-5-6-9-14(2)26;1-13(2)8-10-24-12-15-18-16(22-20(21)19(15)23-24)6-5-7-17(18)25-11-9-14(3)4;1-4-26-11-15-23-17-18(24(15)3)16-13(22-19(17)20)7-5-8-14(16)27-10-6-9-21-12(2)25;1-4-5-10-23-12-14-17-15(21-19(20)18(14)22-23)7-6-8-16(17)24-11-9-13(2)3;1-3-23-10-13-21-15-16(22(13)2)14-11(20-17(15)19)6-4-7-12(14)24-9-5-8-18;1-9(2)6-7-19-8-10-13-11(4-3-5-12(13)20)17-15(16)14(10)18-19;12-11-10-6(4-5-13-10)9-7(14-11)2-1-3-8(9)15/h8,10-11H,4-7,9,12-13H2,1-3H3,(H2,22,23);5-7,12-14H,8-11H2,1-4H3,(H2,21,22);5,7-8H,4,6,9-11H2,1-3H3,(H2,20,22)(H,21,25);6-8,12-13H,4-5,9-11H2,1-3H3,(H2,20,21);4,6-7H,3,5,8-10,18H2,1-2H3,(H2,19,20);3-5,8-9,20H,6-7H2,1-2H3,(H2,16,17);1-4,15H,5H2,(H2,12,14).

What are the key properties of 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine?

7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine has a molecular weight of 2221.79 g/mol, XLogP of 19.77, 42 rotatable bonds, 11 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxyheptan-2-one;N-[3-[4-amino-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-9-yl]oxypropyl]acetamide;4-amino-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-9-ol;9-(3-aminopropoxy)-2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine;4-amino-2H-pyrrolo[2,3-c]quinolin-9-ol;2-butyl-9-(3-methylbutoxy)pyrazolo[3,4-c]quinolin-4-amine;9-(3-methylbutoxy)-2-(3-methylbutyl)pyrazolo[3,4-c]quinolin-4-amine is sourced from PubChem (CID 161010510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).