5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one

C104H125N25O8 — CID 160583057

About 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one

5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 160583057) has the molecular formula C104H125N25O8 and a molecular weight of 1853.31 g/mol. Its IUPAC name is 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

• Compound Name: 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one
• PubChem CID: 160583057
• Molecular Formula: C104H125N25O8
• Molecular Weight: 1853.31 g/mol
• Exact Mass: 1852.01
• IUPAC Name: 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one
• SMILES: C#Cc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.C#Cc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCNC.C#Cc1ccc2c(c1)c1n[nH]c(CCOC)c1c(=O)n2CCCN.CCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.COCCCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCCN(C)C)cc21
• InChI: InChI=1S/C19H27N5O.C18H24N4O2.C18H20N4O2.C17H18N4O.C16H20N4O.C16H16N4O/c1-13-17-18(22-21-13)15-12-14(6-4-10-23(2)3)7-8-16(15)24(19(17)25)11-5-9-20;1-12-16-17(21-20-12)14-11-13(5-3-10-24-2)6-7-15(14)22(18(16)23)9-4-8-19;1-3-12-5-6-15-13(11-12)17-16(14(20-21-17)7-10-24-2)18(23)22(15)9-4-8-19;1-4-12-6-7-14-13(10-12)16-15(11(2)19-20-16)17(22)21(14)9-5-8-18-3;2*1-3-11-5-6-13-12(9-11)15-14(10(2)18-19-15)16(21)20(13)8-4-7-17/h7-8,12H,4-6,9-11,20H2,1-3H3,(H,21,22);6-7,11H,3-5,8-10,19H2,1-2H3,(H,20,21);1,5-6,11H,4,7-10,19H2,2H3,(H,20,21);1,6-7,10,18H,5,8-9H2,2-3H3,(H,19,20);5-6,9H,3-4,7-8,17H2,1-2H3,(H,18,19);1,5-6,9H,4,7-8,17H2,2H3,(H,18,19)
• InChIKey: RCANSDQNKYIEFS-UHFFFAOYSA-N
• XLogP: 10.93
• TPSA: 467.91 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 27
• Rotatable Bonds: 31
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1853.31
LogP ≤ 5	10.93
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The IUPAC name of 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one (CID 160583057) is 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one.

What is the SMILES notation for 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The canonical SMILES for 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one is C#Cc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.C#Cc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCNC.C#Cc1ccc2c(c1)c1n[nH]c(CCOC)c1c(=O)n2CCCN.CCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.COCCCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCCN(C)C)cc21.

What is the InChIKey of 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The InChIKey is RCANSDQNKYIEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O.C18H24N4O2.C18H20N4O2.C17H18N4O.C16H20N4O.C16H16N4O/c1-13-17-18(22-21-13)15-12-14(6-4-10-23(2)3)7-8-16(15)24(19(17)25)11-5-9-20;1-12-16-17(21-20-12)14-11-13(5-3-10-24-2)6-7-15(14)22(18(16)23)9-4-8-19;1-3-12-5-6-15-13(11-12)17-16(14(20-21-17)7-10-24-2)18(23)22(15)9-4-8-19;1-4-12-6-7-14-13(10-12)16-15(11(2)19-20-16)17(22)21(14)9-5-8-18-3;2*1-3-11-5-6-13-12(9-11)15-14(10(2)18-19-15)16(21)20(13)8-4-7-17/h7-8,12H,4-6,9-11,20H2,1-3H3,(H,21,22);6-7,11H,3-5,8-10,19H2,1-2H3,(H,20,21);1,5-6,11H,4,7-10,19H2,2H3,(H,20,21);1,6-7,10,18H,5,8-9H2,2-3H3,(H,19,20);5-6,9H,3-4,7-8,17H2,1-2H3,(H,18,19);1,5-6,9H,4,7-8,17H2,2H3,(H,18,19).

What are the key properties of 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 1853.31 g/mol, XLogP of 10.93, 31 rotatable bonds, 12 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-aminopropyl)-8-[3-(dimethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-ethynyl-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-methoxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethynyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 160583057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).