5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine

C72H79F4N21O7 — CID 159284118

About 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine

5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine (PubChem CID 159284118) has the molecular formula C72H79F4N21O7 and a molecular weight of 1426.56 g/mol. Its IUPAC name is 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine.

Molecular Properties

• Compound Name: 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine
• PubChem CID: 159284118
• Molecular Formula: C72H79F4N21O7
• Molecular Weight: 1426.56 g/mol
• Exact Mass: 1425.64
• IUPAC Name: 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine
• SMILES: COCCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(F)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(F)cc21.Cc1[nH]nc2c1c(=O)n(CCCO)c1ccc(F)cc21.Cc1[nH]nc2c1c(=O)n(CCN=C(N)N)c1ccccc21.Cc1[nH]nc2c1c(=O)n(C[C@H](C)N)c1ccc(F)cc21
• InChI: InChI=1S/C16H19FN4O2.2C14H15FN4O.C14H14FN3O2.C14H16N6O/c1-23-8-5-12-14-15(20-19-12)11-9-10(17)3-4-13(11)21(16(14)22)7-2-6-18;1-7(16)6-19-11-4-3-9(15)5-10(11)13-12(14(19)20)8(2)17-18-13;1-8-12-13(18-17-8)10-7-9(15)3-4-11(10)19(14(12)20)6-2-5-16;1-8-12-13(17-16-8)10-7-9(15)3-4-11(10)18(14(12)20)5-2-6-19;1-8-11-12(19-18-8)9-4-2-3-5-10(9)20(13(11)21)7-6-17-14(15)16/h3-4,9H,2,5-8,18H2,1H3,(H,19,20);3-5,7H,6,16H2,1-2H3,(H,17,18);3-4,7H,2,5-6,16H2,1H3,(H,17,18);3-4,7,19H,2,5-6H2,1H3,(H,16,17);2-5H,6-7H2,1H3,(H,18,19)(H4,15,16,17)/t;7-;;;/m.0.../s1
• InChIKey: KZHGUYUZMNSXOX-DQKOFLAZSA-N
• XLogP: 7.07
• TPSA: 425.32 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 21
• Rotatable Bonds: 17
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1426.56
LogP ≤ 5	7.07
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine?

The IUPAC name of 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine (CID 159284118) is 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine.

What is the SMILES notation for 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine?

The canonical SMILES for 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine is COCCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(F)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(F)cc21.Cc1[nH]nc2c1c(=O)n(CCCO)c1ccc(F)cc21.Cc1[nH]nc2c1c(=O)n(CCN=C(N)N)c1ccccc21.Cc1[nH]nc2c1c(=O)n(C[C@H](C)N)c1ccc(F)cc21.

What is the InChIKey of 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine?

The InChIKey is KZHGUYUZMNSXOX-DQKOFLAZSA-N. The full InChI is InChI=1S/C16H19FN4O2.2C14H15FN4O.C14H14FN3O2.C14H16N6O/c1-23-8-5-12-14-15(20-19-12)11-9-10(17)3-4-13(11)21(16(14)22)7-2-6-18;1-7(16)6-19-11-4-3-9(15)5-10(11)13-12(14(19)20)8(2)17-18-13;1-8-12-13(18-17-8)10-7-9(15)3-4-11(10)19(14(12)20)6-2-5-16;1-8-12-13(17-16-8)10-7-9(15)3-4-11(10)18(14(12)20)5-2-6-19;1-8-11-12(19-18-8)9-4-2-3-5-10(9)20(13(11)21)7-6-17-14(15)16/h3-4,9H,2,5-8,18H2,1H3,(H,19,20);3-5,7H,6,16H2,1-2H3,(H,17,18);3-4,7H,2,5-6,16H2,1H3,(H,17,18);3-4,7,19H,2,5-6H2,1H3,(H,16,17);2-5H,6-7H2,1H3,(H,18,19)(H4,15,16,17)/t;7-;;;/m.0.../s1.

What are the key properties of 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine?

5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine has a molecular weight of 1426.56 g/mol, XLogP of 7.07, 17 rotatable bonds, 11 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-aminopropyl)-8-fluoro-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-[(2S)-2-aminopropyl]-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-fluoro-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-fluoro-5-(3-hydroxypropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;2-[2-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)ethyl]guanidine is sourced from PubChem (CID 159284118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).