5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one

C108H112N28O9S2 — CID 158991547

About 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one

5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 158991547) has the molecular formula C108H112N28O9S2 and a molecular weight of 2010.40 g/mol. Its IUPAC name is 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

• Compound Name: 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one
• PubChem CID: 158991547
• Molecular Formula: C108H112N28O9S2
• Molecular Weight: 2010.40 g/mol
• Exact Mass: 2008.86
• IUPAC Name: 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one
• SMILES: COCCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccoc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccco3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cccs3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccsc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cnc[nH]3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ncc[nH]3)cc21
• InChI: InChI=1S/C20H22N4O3.C18H18N4O2.2C18H18N4OS.2C17H18N6O/c1-26-9-6-16-18-19(23-22-16)15-11-13(14-5-10-27-12-14)3-4-17(15)24(20(18)25)8-2-7-21;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-11-16-17(21-20-11)14-9-12(13-5-8-24-10-13)3-4-15(14)22(18(16)23)7-2-6-19;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-10-14-15(22-21-10)12-9-11(16-19-6-7-20-16)3-4-13(12)23(17(14)24)8-2-5-18;1-10-15-16(22-21-10)12-7-11(13-8-19-9-20-13)3-4-14(12)23(17(15)24)6-2-5-18/h3-5,10-12H,2,6-9,21H2,1H3,(H,22,23);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-5,8-10H,2,6-7,19H2,1H3,(H,20,21);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-4,6-7,9H,2,5,8,18H2,1H3,(H,19,20)(H,21,22);3-4,7-9H,2,5-6,18H2,1H3,(H,19,20)(H,21,22)
• InChIKey: JQFKLSIUHYJLAV-UHFFFAOYSA-N
• XLogP: 15.85
• TPSA: 553.07 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 31
• Rotatable Bonds: 27
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2010.40
LogP ≤ 5	15.85
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?

The IUPAC name of 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one (CID 158991547) is 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one.

What is the SMILES notation for 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?

The canonical SMILES for 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one is COCCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccoc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccco3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cccs3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccsc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cnc[nH]3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ncc[nH]3)cc21.

What is the InChIKey of 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?

The InChIKey is JQFKLSIUHYJLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3.C18H18N4O2.2C18H18N4OS.2C17H18N6O/c1-26-9-6-16-18-19(23-22-16)15-11-13(14-5-10-27-12-14)3-4-17(15)24(20(18)25)8-2-7-21;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-11-16-17(21-20-11)14-9-12(13-5-8-24-10-13)3-4-15(14)22(18(16)23)7-2-6-19;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-10-14-15(22-21-10)12-9-11(16-19-6-7-20-16)3-4-13(12)23(17(14)24)8-2-5-18;1-10-15-16(22-21-10)12-7-11(13-8-19-9-20-13)3-4-14(12)23(17(15)24)6-2-5-18/h3-5,10-12H,2,6-9,21H2,1H3,(H,22,23);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-5,8-10H,2,6-7,19H2,1H3,(H,20,21);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-4,6-7,9H,2,5,8,18H2,1H3,(H,19,20)(H,21,22);3-4,7-9H,2,5-6,18H2,1H3,(H,19,20)(H,21,22).

What are the key properties of 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?

5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 2010.40 g/mol, XLogP of 15.85, 27 rotatable bonds, 14 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(1H-imidazol-5-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 158991547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).