7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one

C120H127F3N26O10 — CID 158283464

About 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one

7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one (PubChem CID 158283464) has the molecular formula C120H127F3N26O10 and a molecular weight of 2150.50 g/mol. Its IUPAC name is 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one.

Molecular Properties

• Compound Name: 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one
• PubChem CID: 158283464
• Molecular Formula: C120H127F3N26O10
• Molecular Weight: 2150.50 g/mol
• Exact Mass: 2149.02
• IUPAC Name: 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one
• SMILES: CC(C)N1CCN(c2cc(N3CCN(C(C)C)CC3)c3ncc4c(=O)n(-c5ccccc5)[nH]c4c3c2)CC1.CC1CC(C)CN(c2cc3ncc4c(=O)n(-c5ccccc5)[nH]c4c3cc2F)C1.O=c1c2cnc3c(N4CCOCC4)cc(N4CCOCC4)cc3c2[nH]n1-c1ccccc1.O=c1c2cnc3cc(N4CCOCC4)c(F)c(N4CCOCC4)c3c2[nH]n1-c1ccccc1.O=c1c2cnc3cc(N4CCOCC4)c(F)cc3c2[nH]n1-c1ccccn1
• InChI: InChI=1S/C30H39N7O.C24H24FN5O3.C24H25N5O3.C23H23FN4O.C19H16FN5O2/c1-21(2)33-10-14-35(15-11-33)24-18-25-28-26(30(38)37(32-28)23-8-6-5-7-9-23)20-31-29(25)27(19-24)36-16-12-34(13-17-36)22(3)4;25-21-19(28-6-10-32-11-7-28)14-18-20(23(21)29-8-12-33-13-9-29)22-17(15-26-18)24(31)30(27-22)16-4-2-1-3-5-16;30-24-20-16-25-23-19(22(20)26-29(24)17-4-2-1-3-5-17)14-18(27-6-10-31-11-7-27)15-21(23)28-8-12-32-13-9-28;1-14-8-15(2)13-27(12-14)21-10-20-17(9-19(21)24)22-18(11-25-20)23(29)28(26-22)16-6-4-3-5-7-16;20-14-9-12-15(10-16(14)24-5-7-27-8-6-24)22-11-13-18(12)23-25(19(13)26)17-3-1-2-4-21-17/h5-9,18-22,32H,10-17H2,1-4H3;1-5,14-15,27H,6-13H2;1-5,14-16,26H,6-13H2;3-7,9-11,14-15,26H,8,12-13H2,1-2H3;1-4,9-11,23H,5-8H2
• InChIKey: WCACKBQUTWUELN-UHFFFAOYSA-N
• XLogP: 15.87
• TPSA: 344.84 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 31
• Rotatable Bonds: 15
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2150.50
LogP ≤ 5	15.87
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het_65_B(7)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The IUPAC name of 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one (CID 158283464) is 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one.

What is the SMILES notation for 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The canonical SMILES for 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one is CC(C)N1CCN(c2cc(N3CCN(C(C)C)CC3)c3ncc4c(=O)n(-c5ccccc5)[nH]c4c3c2)CC1.CC1CC(C)CN(c2cc3ncc4c(=O)n(-c5ccccc5)[nH]c4c3cc2F)C1.O=c1c2cnc3c(N4CCOCC4)cc(N4CCOCC4)cc3c2[nH]n1-c1ccccc1.O=c1c2cnc3cc(N4CCOCC4)c(F)c(N4CCOCC4)c3c2[nH]n1-c1ccccc1.O=c1c2cnc3cc(N4CCOCC4)c(F)cc3c2[nH]n1-c1ccccn1.

What is the InChIKey of 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one?

The InChIKey is WCACKBQUTWUELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H39N7O.C24H24FN5O3.C24H25N5O3.C23H23FN4O.C19H16FN5O2/c1-21(2)33-10-14-35(15-11-33)24-18-25-28-26(30(38)37(32-28)23-8-6-5-7-9-23)20-31-29(25)27(19-24)36-16-12-34(13-17-36)22(3)4;25-21-19(28-6-10-32-11-7-28)14-18-20(23(21)29-8-12-33-13-9-29)22-17(15-26-18)24(31)30(27-22)16-4-2-1-3-5-16;30-24-20-16-25-23-19(22(20)26-29(24)17-4-2-1-3-5-17)14-18(27-6-10-31-11-7-27)15-21(23)28-8-12-32-13-9-28;1-14-8-15(2)13-27(12-14)21-10-20-17(9-19(21)24)22-18(11-25-20)23(29)28(26-22)16-6-4-3-5-7-16;20-14-9-12-15(10-16(14)24-5-7-27-8-6-24)22-11-13-18(12)23-25(19(13)26)17-3-1-2-4-21-17/h5-9,18-22,32H,10-17H2,1-4H3;1-5,14-15,27H,6-13H2;1-5,14-16,26H,6-13H2;3-7,9-11,14-15,26H,8,12-13H2,1-2H3;1-4,9-11,23H,5-8H2.

What are the key properties of 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one?

7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one has a molecular weight of 2150.50 g/mol, XLogP of 15.87, 15 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(3,5-dimethylpiperidin-1-yl)-8-fluoro-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;6,8-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7,9-dimorpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-fluoro-7-morpholin-4-yl-2-pyridin-2-yl-1H-pyrazolo[4,3-c]quinolin-3-one;2-phenyl-6,8-bis(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one is sourced from PubChem (CID 158283464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).