N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide

C95H128F4N20O10 — CID 159456755

About N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide

N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide (PubChem CID 159456755) has the molecular formula C95H128F4N20O10 and a molecular weight of 1786.19 g/mol. Its IUPAC name is N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide.

Molecular Properties

• Compound Name: N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide
• PubChem CID: 159456755
• Molecular Formula: C95H128F4N20O10
• Molecular Weight: 1786.19 g/mol
• Exact Mass: 1785.01
• IUPAC Name: N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide
• SMILES: CC(C)N1CCc2c(c(-c3ccc(F)c(F)c3)nn2C(=O)N[C@H](C(=O)N2CC[C@H](O)C2)C(C)(C)C)C1.CCN1CCc2c(c(-c3ccc(F)c(F)c3)nn2C(=O)N[C@H](C(=O)N2CC[C@H](O)C2)C(C)(C)C)C1.CN1CCc2c(c(-c3ccccc3)nn2C(=O)N[C@H](C(=O)N2CCC2)C(C)(C)C)C1.CNC(=O)[C@@H](NC(=O)n1nc(-c2ccccc2)c2c1CCN(C)C2)C(C)(C)C
• InChI: InChI=1S/C26H35F2N5O3.C25H33F2N5O3.C23H31N5O2.C21H29N5O2/c1-15(2)31-11-9-21-18(14-31)22(16-6-7-19(27)20(28)12-16)30-33(21)25(36)29-23(26(3,4)5)24(35)32-10-8-17(34)13-32;1-5-30-10-9-20-17(14-30)21(15-6-7-18(26)19(27)12-15)29-32(20)24(35)28-22(25(2,3)4)23(34)31-11-8-16(33)13-31;1-23(2,3)20(21(29)27-12-8-13-27)24-22(30)28-18-11-14-26(4)15-17(18)19(25-28)16-9-6-5-7-10-16;1-21(2,3)18(19(27)22-4)23-20(28)26-16-11-12-25(5)13-15(16)17(24-26)14-9-7-6-8-10-14/h6-7,12,15,17,23,34H,8-11,13-14H2,1-5H3,(H,29,36);6-7,12,16,22,33H,5,8-11,13-14H2,1-4H3,(H,28,35);5-7,9-10,20H,8,11-15H2,1-4H3,(H,24,30);6-10,18H,11-13H2,1-5H3,(H,22,27)(H,23,28)/t17-,23+;16-,22+;20-;18-/m0011/s1
• InChIKey: LUBNBEMRPRUQBG-PGORUKNASA-N
• XLogP: 10.93
• TPSA: 331.13 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 22
• Rotatable Bonds: 14
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1786.19
LogP ≤ 5	10.93
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide?

The IUPAC name of N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide (CID 159456755) is N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide.

What is the SMILES notation for N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide?

The canonical SMILES for N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide is CC(C)N1CCc2c(c(-c3ccc(F)c(F)c3)nn2C(=O)N[C@H](C(=O)N2CC[C@H](O)C2)C(C)(C)C)C1.CCN1CCc2c(c(-c3ccc(F)c(F)c3)nn2C(=O)N[C@H](C(=O)N2CC[C@H](O)C2)C(C)(C)C)C1.CN1CCc2c(c(-c3ccccc3)nn2C(=O)N[C@H](C(=O)N2CCC2)C(C)(C)C)C1.CNC(=O)[C@@H](NC(=O)n1nc(-c2ccccc2)c2c1CCN(C)C2)C(C)(C)C.

What is the InChIKey of N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide?

The InChIKey is LUBNBEMRPRUQBG-PGORUKNASA-N. The full InChI is InChI=1S/C26H35F2N5O3.C25H33F2N5O3.C23H31N5O2.C21H29N5O2/c1-15(2)31-11-9-21-18(14-31)22(16-6-7-19(27)20(28)12-16)30-33(21)25(36)29-23(26(3,4)5)24(35)32-10-8-17(34)13-32;1-5-30-10-9-20-17(14-30)21(15-6-7-18(26)19(27)12-15)29-32(20)24(35)28-22(25(2,3)4)23(34)31-11-8-16(33)13-31;1-23(2,3)20(21(29)27-12-8-13-27)24-22(30)28-18-11-14-26(4)15-17(18)19(25-28)16-9-6-5-7-10-16;1-21(2,3)18(19(27)22-4)23-20(28)26-16-11-12-25(5)13-15(16)17(24-26)14-9-7-6-8-10-14/h6-7,12,15,17,23,34H,8-11,13-14H2,1-5H3,(H,29,36);6-7,12,16,22,33H,5,8-11,13-14H2,1-4H3,(H,28,35);5-7,9-10,20H,8,11-15H2,1-4H3,(H,24,30);6-10,18H,11-13H2,1-5H3,(H,22,27)(H,23,28)/t17-,23+;16-,22+;20-;18-/m0011/s1.

What are the key properties of N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide?

N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide has a molecular weight of 1786.19 g/mol, XLogP of 10.93, 14 rotatable bonds, 7 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2S)-1-(azetidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-5-ethyl-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;3-(3,4-difluorophenyl)-N-[(2S)-1-[(3S)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-5-propan-2-yl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide;N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-5-methyl-3-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-1-carboxamide is sourced from PubChem (CID 159456755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).