5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione

C83H94ClFN24O8SSi — CID 158480933

About 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione

5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione (PubChem CID 158480933) has the molecular formula C83H94ClFN24O8SSi and a molecular weight of 1670.43 g/mol. Its IUPAC name is 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione.

Molecular Properties

• Compound Name: 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione
• PubChem CID: 158480933
• Molecular Formula: C83H94ClFN24O8SSi
• Molecular Weight: 1670.43 g/mol
• Exact Mass: 1668.68
• IUPAC Name: 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione
• SMILES: CSc1n[nH]c2c1c(=O)n(CCCN)c1ccccc21.C[Si](C)(C)c1ccc2c(c1)c1[nH][nH]c(=O)c1c(=O)n2CCCN.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.NCCCn1c(=O)c2c(=O)[nH][nH]c2c2ccccc21.NCCCn1c(=O)c2c(Cl)[nH]nc2c2ccccc21.NCCCn1c(=O)c2c(F)[nH]nc2c2ccccc21
• InChI: InChI=1S/C16H22N4O2Si.C14H16N4OS.C14H16N4O.C13H13ClN4O.C13H13FN4O.C13H14N4O2/c1-23(2,3)10-5-6-12-11(9-10)14-13(15(21)19-18-14)16(22)20(12)8-4-7-17;1-20-13-11-12(16-17-13)9-5-2-3-6-10(9)18(14(11)19)8-4-7-15;1-9-12-13(17-16-9)10-5-2-3-6-11(10)18(14(12)19)8-4-7-15;2*14-12-10-11(16-17-12)8-4-1-2-5-9(8)18(13(10)19)7-3-6-15;14-6-3-7-17-9-5-2-1-4-8(9)11-10(13(17)19)12(18)16-15-11/h5-6,9H,4,7-8,17H2,1-3H3,(H2,18,19,21);2-3,5-6H,4,7-8,15H2,1H3,(H,16,17);2-3,5-6H,4,7-8,15H2,1H3,(H,16,17);2*1-2,4-5H,3,6-7,15H2,(H,16,17);1-2,4-5H,3,6-7,14H2,(H2,15,16,18)
• InChIKey: HHMZDJGYMSSNOO-UHFFFAOYSA-N
• XLogP: 8.31
• TPSA: 500.14 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 25
• Rotatable Bonds: 20
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1670.43
LogP ≤ 5	8.31
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione?

The IUPAC name of 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione (CID 158480933) is 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione.

What is the SMILES notation for 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione?

The canonical SMILES for 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione is CSc1n[nH]c2c1c(=O)n(CCCN)c1ccccc21.C[Si](C)(C)c1ccc2c(c1)c1[nH][nH]c(=O)c1c(=O)n2CCCN.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.NCCCn1c(=O)c2c(=O)[nH][nH]c2c2ccccc21.NCCCn1c(=O)c2c(Cl)[nH]nc2c2ccccc21.NCCCn1c(=O)c2c(F)[nH]nc2c2ccccc21.

What is the InChIKey of 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione?

The InChIKey is HHMZDJGYMSSNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2Si.C14H16N4OS.C14H16N4O.C13H13ClN4O.C13H13FN4O.C13H14N4O2/c1-23(2,3)10-5-6-12-11(9-10)14-13(15(21)19-18-14)16(22)20(12)8-4-7-17;1-20-13-11-12(16-17-13)9-5-2-3-6-10(9)18(14(11)19)8-4-7-15;1-9-12-13(17-16-9)10-5-2-3-6-11(10)18(14(12)19)8-4-7-15;2*14-12-10-11(16-17-12)8-4-1-2-5-9(8)18(13(10)19)7-3-6-15;14-6-3-7-17-9-5-2-1-4-8(9)11-10(13(17)19)12(18)16-15-11/h5-6,9H,4,7-8,17H2,1-3H3,(H2,18,19,21);2-3,5-6H,4,7-8,15H2,1H3,(H,16,17);2-3,5-6H,4,7-8,15H2,1H3,(H,16,17);2*1-2,4-5H,3,6-7,15H2,(H,16,17);1-2,4-5H,3,6-7,14H2,(H2,15,16,18).

What are the key properties of 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione?

5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione has a molecular weight of 1670.43 g/mol, XLogP of 8.31, 20 rotatable bonds, 14 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-aminopropyl)-3-chloro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione;5-(3-aminopropyl)-3-fluoro-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methylsulfanyl-1H-pyrazolo[4,5-c]quinolin-4-one;5-(3-aminopropyl)-8-trimethylsilyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione is sourced from PubChem (CID 158480933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).