N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C93H100N24O7 — CID 167576415

About N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 167576415) has the molecular formula C93H100N24O7 and a molecular weight of 1669.00 g/mol. Its IUPAC name is N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

• Compound Name: N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
• PubChem CID: 167576415
• Molecular Formula: C93H100N24O7
• Molecular Weight: 1669.00 g/mol
• Exact Mass: 1667.84
• IUPAC Name: N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
• SMILES: CC(C)(O)C1CN(c2cc(-c3ccc(N4CC5CC(C4)N5Cc4ccc(OC5CC5)nc4)nc3)c3c(C#N)cnn3c2)C1.COc1ccc(CN2C3CC2CN(c2ccc(-c4cc(NC(=O)C(C)(C)O)cn5ncc(C#N)c45)cn2)C3)cn1.[2H]C([2H])([2H])Oc1ccc(CN2C3CC2CN(c2ccc(-c4cc(N5CC(C(C)(C)O)C5)cn5ncc(C#N)c45)cn2)C3)cn1
• InChI: InChI=1S/C33H36N8O2.C31H34N8O2.C29H30N8O3/c1-33(2,42)24-16-38(17-24)25-10-29(32-23(11-34)14-37-41(32)20-25)22-4-7-30(35-13-22)39-18-26-9-27(19-39)40(26)15-21-3-8-31(36-12-21)43-28-5-6-28;1-31(2,40)23-15-36(16-23)24-9-27(30-22(10-32)13-35-39(30)19-24)21-5-6-28(33-12-21)37-17-25-8-26(18-37)38(25)14-20-4-7-29(41-3)34-11-20;1-29(2,39)28(38)34-21-8-24(27-20(10-30)13-33-37(27)15-21)19-5-6-25(31-12-19)35-16-22-9-23(17-35)36(22)14-18-4-7-26(40-3)32-11-18/h3-4,7-8,10,12-14,20,24,26-28,42H,5-6,9,15-19H2,1-2H3;4-7,9,11-13,19,23,25-26,40H,8,14-18H2,1-3H3;4-8,11-13,15,22-23,39H,9,14,16-17H2,1-3H3,(H,34,38)/i;3D3
• InChIKey: GPDHIQAFLYLHFU-UMJUAPLUSA-N
• XLogP: 10.06
• TPSA: 344.01 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 30
• Rotatable Bonds: 23
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1669.00
LogP ≤ 5	10.06
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

The IUPAC name of N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 167576415) is N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

What is the SMILES notation for N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

The canonical SMILES for N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is CC(C)(O)C1CN(c2cc(-c3ccc(N4CC5CC(C4)N5Cc4ccc(OC5CC5)nc4)nc3)c3c(C#N)cnn3c2)C1.COc1ccc(CN2C3CC2CN(c2ccc(-c4cc(NC(=O)C(C)(C)O)cn5ncc(C#N)c45)cn2)C3)cn1.[2H]C([2H])([2H])Oc1ccc(CN2C3CC2CN(c2ccc(-c4cc(N5CC(C(C)(C)O)C5)cn5ncc(C#N)c45)cn2)C3)cn1.

What is the InChIKey of N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

The InChIKey is GPDHIQAFLYLHFU-UMJUAPLUSA-N. The full InChI is InChI=1S/C33H36N8O2.C31H34N8O2.C29H30N8O3/c1-33(2,42)24-16-38(17-24)25-10-29(32-23(11-34)14-37-41(32)20-25)22-4-7-30(35-13-22)39-18-26-9-27(19-39)40(26)15-21-3-8-31(36-12-21)43-28-5-6-28;1-31(2,40)23-15-36(16-23)24-9-27(30-22(10-32)13-35-39(30)19-24)21-5-6-28(33-12-21)37-17-25-8-26(18-37)38(25)14-20-4-7-29(41-3)34-11-20;1-29(2,39)28(38)34-21-8-24(27-20(10-30)13-33-37(27)15-21)19-5-6-25(31-12-19)35-16-22-9-23(17-35)36(22)14-18-4-7-26(40-3)32-11-18/h3-4,7-8,10,12-14,20,24,26-28,42H,5-6,9,15-19H2,1-2H3;4-7,9,11-13,19,23,25-26,40H,8,14-18H2,1-3H3;4-8,11-13,15,22-23,39H,9,14,16-17H2,1-3H3,(H,34,38)/i;3D3;.

What are the key properties of N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 1669.00 g/mol, XLogP of 10.06, 23 rotatable bonds, 4 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-cyano-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]-2-hydroxy-2-methylpropanamide;4-[6-[6-[(6-cyclopropyloxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-4-[6-[6-[[6-(trideuteriomethoxy)-3-pyridinyl]methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 167576415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).