8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one

C87H111Cl3N20O7 — CID 162045384

About 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one

8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 162045384) has the molecular formula C87H111Cl3N20O7 and a molecular weight of 1655.34 g/mol. Its IUPAC name is 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

• Compound Name: 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one
• PubChem CID: 162045384
• Molecular Formula: C87H111Cl3N20O7
• Molecular Weight: 1655.34 g/mol
• Exact Mass: 1652.80
• IUPAC Name: 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one
• SMILES: CCCNCCCn1c(=O)c2c(C)[nH]nc2c2cc(Cl)ccc21.CCNCCCn1c(=O)c2c(C)[nH]nc2c2cc(Cl)ccc21.CNCCCn1c(=O)c2c(CCOC)[nH]nc2c2cc(C)ccc21.CNCCCn1c(=O)c2c(CCOC)[nH]nc2c2cc(Cl)ccc21.Cc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCNCC(C)C
• InChI: InChI=1S/C19H26N4O.C18H24N4O2.C17H21ClN4O2.C17H21ClN4O.C16H19ClN4O/c1-12(2)11-20-8-5-9-23-16-7-6-13(3)10-15(16)18-17(19(23)24)14(4)21-22-18;1-12-5-6-15-13(11-12)17-16(14(20-21-17)7-10-24-3)18(23)22(15)9-4-8-19-2;1-19-7-3-8-22-14-5-4-11(18)10-12(14)16-15(17(22)23)13(20-21-16)6-9-24-2;1-3-7-19-8-4-9-22-14-6-5-12(18)10-13(14)16-15(17(22)23)11(2)20-21-16;1-3-18-7-4-8-21-13-6-5-11(17)9-12(13)15-14(16(21)22)10(2)19-20-15/h6-7,10,12,20H,5,8-9,11H2,1-4H3,(H,21,22);5-6,11,19H,4,7-10H2,1-3H3,(H,20,21);4-5,10,19H,3,6-9H2,1-2H3,(H,20,21);5-6,10,19H,3-4,7-9H2,1-2H3,(H,20,21);5-6,9,18H,3-4,7-8H2,1-2H3,(H,19,20)
• InChIKey: YXUVHFSSIVFLHU-UHFFFAOYSA-N
• XLogP: 13.51
• TPSA: 332.01 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 22
• Rotatable Bonds: 31
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1655.34
LogP ≤ 5	13.51
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The IUPAC name of 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one (CID 162045384) is 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one.

What is the SMILES notation for 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The canonical SMILES for 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one is CCCNCCCn1c(=O)c2c(C)[nH]nc2c2cc(Cl)ccc21.CCNCCCn1c(=O)c2c(C)[nH]nc2c2cc(Cl)ccc21.CNCCCn1c(=O)c2c(CCOC)[nH]nc2c2cc(C)ccc21.CNCCCn1c(=O)c2c(CCOC)[nH]nc2c2cc(Cl)ccc21.Cc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCNCC(C)C.

What is the InChIKey of 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The InChIKey is YXUVHFSSIVFLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O.C18H24N4O2.C17H21ClN4O2.C17H21ClN4O.C16H19ClN4O/c1-12(2)11-20-8-5-9-23-16-7-6-13(3)10-15(16)18-17(19(23)24)14(4)21-22-18;1-12-5-6-15-13(11-12)17-16(14(20-21-17)7-10-24-3)18(23)22(15)9-4-8-19-2;1-19-7-3-8-22-14-5-4-11(18)10-12(14)16-15(17(22)23)13(20-21-16)6-9-24-2;1-3-7-19-8-4-9-22-14-6-5-12(18)10-13(14)16-15(17(22)23)11(2)20-21-16;1-3-18-7-4-8-21-13-6-5-11(17)9-12(13)15-14(16(21)22)10(2)19-20-15/h6-7,10,12,20H,5,8-9,11H2,1-4H3,(H,21,22);5-6,11,19H,4,7-10H2,1-3H3,(H,20,21);4-5,10,19H,3,6-9H2,1-2H3,(H,20,21);5-6,10,19H,3-4,7-9H2,1-2H3,(H,20,21);5-6,9,18H,3-4,7-8H2,1-2H3,(H,19,20).

What are the key properties of 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 1655.34 g/mol, XLogP of 13.51, 31 rotatable bonds, 10 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 8-chloro-5-[3-(ethylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-(2-methoxyethyl)-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;8-chloro-3-methyl-5-[3-(propylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3,8-dimethyl-5-[3-(2-methylpropylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-(2-methoxyethyl)-8-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 162045384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).