5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one

C89H103ClN20O6 — CID 160822832

About 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one

5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 160822832) has the molecular formula C89H103ClN20O6 and a molecular weight of 1584.39 g/mol. Its IUPAC name is 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

• Compound Name: 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one
• PubChem CID: 160822832
• Molecular Formula: C89H103ClN20O6
• Molecular Weight: 1584.39 g/mol
• Exact Mass: 1582.81
• IUPAC Name: 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one
• SMILES: CNCC(C)(C)Cn1c(=O)c2c(C)[nH]nc2c2ccccc21.CNCCCn1c(=O)c2c(C)[nH]nc2c2ccccc21.Cc1[nH]nc2c1c(=O)n(CC(C)(C)CN)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCC1CCCN1)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCC1CCCN1C(=O)c1ccc(Cl)cc1)c1ccccc21
• InChI: InChI=1S/C24H23ClN4O2.C17H20N4O.C17H22N4O.C16H20N4O.C15H18N4O/c1-15-21-22(27-26-15)19-6-2-3-7-20(19)29(24(21)31)14-12-18-5-4-13-28(18)23(30)16-8-10-17(25)11-9-16;1-11-15-16(20-19-11)13-6-2-3-7-14(13)21(17(15)22)10-8-12-5-4-9-18-12;1-11-14-15(20-19-11)12-7-5-6-8-13(12)21(16(14)22)10-17(2,3)9-18-4;1-10-13-14(19-18-10)11-6-4-5-7-12(11)20(15(13)21)9-16(2,3)8-17;1-10-13-14(18-17-10)11-6-3-4-7-12(11)19(15(13)20)9-5-8-16-2/h2-3,6-11,18H,4-5,12-14H2,1H3,(H,26,27);2-3,6-7,12,18H,4-5,8-10H2,1H3,(H,19,20);5-8,18H,9-10H2,1-4H3,(H,19,20);4-7H,8-9,17H2,1-3H3,(H,18,19);3-4,6-7,16H,5,8-9H2,1-2H3,(H,17,18)
• InChIKey: SFTSHGZIUJHXJZ-UHFFFAOYSA-N
• XLogP: 13.26
• TPSA: 335.82 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 20
• Rotatable Bonds: 18
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1584.39
LogP ≤ 5	13.26
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one?

The IUPAC name of 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one (CID 160822832) is 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one.

What is the SMILES notation for 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one?

The canonical SMILES for 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one is CNCC(C)(C)Cn1c(=O)c2c(C)[nH]nc2c2ccccc21.CNCCCn1c(=O)c2c(C)[nH]nc2c2ccccc21.Cc1[nH]nc2c1c(=O)n(CC(C)(C)CN)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCC1CCCN1)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCC1CCCN1C(=O)c1ccc(Cl)cc1)c1ccccc21.

What is the InChIKey of 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one?

The InChIKey is SFTSHGZIUJHXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN4O2.C17H20N4O.C17H22N4O.C16H20N4O.C15H18N4O/c1-15-21-22(27-26-15)19-6-2-3-7-20(19)29(24(21)31)14-12-18-5-4-13-28(18)23(30)16-8-10-17(25)11-9-16;1-11-15-16(20-19-11)13-6-2-3-7-14(13)21(17(15)22)10-8-12-5-4-9-18-12;1-11-14-15(20-19-11)12-7-5-6-8-13(12)21(16(14)22)10-17(2,3)9-18-4;1-10-13-14(19-18-10)11-6-4-5-7-12(11)20(15(13)21)9-16(2,3)8-17;1-10-13-14(18-17-10)11-6-3-4-7-12(11)19(15(13)20)9-5-8-16-2/h2-3,6-11,18H,4-5,12-14H2,1H3,(H,26,27);2-3,6-7,12,18H,4-5,8-10H2,1H3,(H,19,20);5-8,18H,9-10H2,1-4H3,(H,19,20);4-7H,8-9,17H2,1-3H3,(H,18,19);3-4,6-7,16H,5,8-9H2,1-2H3,(H,17,18).

What are the key properties of 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one?

5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 1584.39 g/mol, XLogP of 13.26, 18 rotatable bonds, 9 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-amino-2,2-dimethylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2-[1-(4-chlorobenzoyl)pyrrolidin-2-yl]ethyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[2,2-dimethyl-3-(methylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one;3-methyl-5-(2-pyrrolidin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 160822832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).