5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one

C113H144N26O8 — CID 159067699

About 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one

5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 159067699) has the molecular formula C113H144N26O8 and a molecular weight of 1994.57 g/mol. Its IUPAC name is 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

• Compound Name: 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one
• PubChem CID: 159067699
• Molecular Formula: C113H144N26O8
• Molecular Weight: 1994.57 g/mol
• Exact Mass: 1993.17
• IUPAC Name: 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one
• SMILES: CC(=O)NCCCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.CCCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.CCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCNC.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCCC3CCCC3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCCO)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCc3ccccn3)cc21
• InChI: InChI=1S/C22H30N4O.C21H23N5O.C19H25N5O2.C17H22N4O2.2C17H22N4O/c1-15-20-21(25-24-15)18-14-17(9-4-8-16-6-2-3-7-16)10-11-19(18)26(22(20)27)13-5-12-23;1-14-19-20(25-24-14)17-13-15(6-8-16-5-2-3-11-23-16)7-9-18(17)26(21(19)27)12-4-10-22;1-12-17-18(23-22-12)15-11-14(5-3-9-21-13(2)25)6-7-16(15)24(19(17)26)10-4-8-20;1-11-15-16(20-19-11)13-10-12(4-2-9-22)5-6-14(13)21(17(15)23)8-3-7-18;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;1-3-5-12-6-7-14-13(10-12)16-15(11(2)19-20-16)17(22)21(14)9-4-8-18/h10-11,14,16H,2-9,12-13,23H2,1H3,(H,24,25);2-3,5,7,9,11,13H,4,6,8,10,12,22H2,1H3,(H,24,25);6-7,11H,3-5,8-10,20H2,1-2H3,(H,21,25)(H,22,23);5-6,10,22H,2-4,7-9,18H2,1H3,(H,19,20);6-7,10,18H,4-5,8-9H2,1-3H3,(H,19,20);6-7,10H,3-5,8-9,18H2,1-2H3,(H,19,20)
• InChIKey: JZGQAPFPIQKQNK-UHFFFAOYSA-N
• XLogP: 14.67
• TPSA: 508.43 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 27
• Rotatable Bonds: 36
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1994.57
LogP ≤ 5	14.67
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The IUPAC name of 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one (CID 159067699) is 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-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-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The canonical SMILES for 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one is CC(=O)NCCCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.CCCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCN.CCc1ccc2c(c1)c1n[nH]c(C)c1c(=O)n2CCCNC.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCCC3CCCC3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCCO)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(CCc3ccccn3)cc21.

What is the InChIKey of 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

The InChIKey is JZGQAPFPIQKQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O.C21H23N5O.C19H25N5O2.C17H22N4O2.2C17H22N4O/c1-15-20-21(25-24-15)18-14-17(9-4-8-16-6-2-3-7-16)10-11-19(18)26(22(20)27)13-5-12-23;1-14-19-20(25-24-14)17-13-15(6-8-16-5-2-3-11-23-16)7-9-18(17)26(21(19)27)12-4-10-22;1-12-17-18(23-22-12)15-11-14(5-3-9-21-13(2)25)6-7-16(15)24(19(17)26)10-4-8-20;1-11-15-16(20-19-11)13-10-12(4-2-9-22)5-6-14(13)21(17(15)23)8-3-7-18;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;1-3-5-12-6-7-14-13(10-12)16-15(11(2)19-20-16)17(22)21(14)9-4-8-18/h10-11,14,16H,2-9,12-13,23H2,1H3,(H,24,25);2-3,5,7,9,11,13H,4,6,8,10,12,22H2,1H3,(H,24,25);6-7,11H,3-5,8-10,20H2,1-2H3,(H,21,25)(H,22,23);5-6,10,22H,2-4,7-9,18H2,1H3,(H,19,20);6-7,10,18H,4-5,8-9H2,1-3H3,(H,19,20);6-7,10H,3-5,8-9,18H2,1-2H3,(H,19,20).

What are the key properties of 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one?

5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 1994.57 g/mol, XLogP of 14.67, 36 rotatable bonds, 14 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-aminopropyl)-8-(3-cyclopentylpropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]propyl]acetamide;5-(3-aminopropyl)-3-methyl-8-propyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-pyridin-2-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;8-ethyl-3-methyl-5-[3-(methylamino)propyl]-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 159067699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).