N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C86H82F5N35O8 — CID 158538429

IUPACN-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(Nc2cc(C)cn(-c3cnn(C)c3)c2=O)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)cn(-c3ccc(C)nn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.CNc1cc(Nc2cc(F)cn(-c3ccccn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.CNc1cc(Nc2cccn(-c3ccc(C4CC4)nn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12
InChIInChI=1S/C23H22FN9O2.C21H19F2N9O2.C21H18F2N8O2.C21H23N9O2/c1-25-20-10-18(29-21-13(11-26-33(20)21)22(34)28-17-9-14(17)24)27-16-3-2-8-32(23(16)35)19-7-6-15(30-31-19)12-4-5-12;1-10-3-4-17(30-29-10)31-9-11(22)5-15(21(31)34)26-16-7-18(24-2)32-19(28-16)12(8-25-32)20(33)27-14-6-13(14)23;1-24-18-8-16(29-19-12(9-26-31(18)19)20(32)28-14-7-13(14)23)27-15-6-11(22)10-30(21(15)33)17-4-2-3-5-25-17;1-12-6-16(21(32)29(10-12)14-8-23-28(3)11-14)26-17-7-18(22-2)30-19(27-17)15(9-24-30)20(31)25-13-4-5-13/h2-3,6-8,10-12,14,17,25H,4-5,9H2,1H3,(H,27,29)(H,28,34);3-5,7-9,13-14,24H,6H2,1-2H3,(H,26,28)(H,27,33);2-6,8-10,13-14,24H,7H2,1H3,(H,27,29)(H,28,32);6-11,13,22H,4-5H2,1-3H3,(H,25,31)(H,26,27)/t14-,17+;2*13-,14+;/m111./s1
InChIKeyHOFKXDNYQJOYPK-MTJQONQMSA-N
MW1828.83 g/mol
LogP7.56
Rot. Bonds25

About N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 158538429) has the molecular formula C86H82F5N35O8 and a molecular weight of 1828.83 g/mol. Its IUPAC name is N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID158538429
Molecular FormulaC86H82F5N35O8
Molecular Weight1828.83 g/mol
Exact Mass1827.70
IUPAC NameN-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(Nc2cc(C)cn(-c3cnn(C)c3)c2=O)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)cn(-c3ccc(C)nn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.CNc1cc(Nc2cc(F)cn(-c3ccccn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.CNc1cc(Nc2cccn(-c3ccc(C4CC4)nn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12
InChIInChI=1S/C23H22FN9O2.C21H19F2N9O2.C21H18F2N8O2.C21H23N9O2/c1-25-20-10-18(29-21-13(11-26-33(20)21)22(34)28-17-9-14(17)24)27-16-3-2-8-32(23(16)35)19-7-6-15(30-31-19)12-4-5-12;1-10-3-4-17(30-29-10)31-9-11(22)5-15(21(31)34)26-16-7-18(24-2)32-19(28-16)12(8-25-32)20(33)27-14-6-13(14)23;1-24-18-8-16(29-19-12(9-26-31(18)19)20(32)28-14-7-13(14)23)27-15-6-11(22)10-30(21(15)33)17-4-2-3-5-25-17;1-12-6-16(21(32)29(10-12)14-8-23-28(3)11-14)26-17-7-18(22-2)30-19(27-17)15(9-24-30)20(31)25-13-4-5-13/h2-3,6-8,10-12,14,17,25H,4-5,9H2,1H3,(H,27,29)(H,28,34);3-5,7-9,13-14,24H,6H2,1-2H3,(H,26,28)(H,27,33);2-6,8-10,13-14,24H,7H2,1H3,(H,27,29)(H,28,32);6-11,13,22H,4-5H2,1-3H3,(H,25,31)(H,26,27)/t14-,17+;2*13-,14+;/m111./s1
InChIKeyHOFKXDNYQJOYPK-MTJQONQMSA-N
XLogP7.56
TPSA503.67 Ų
H-Bond Donors12
H-Bond Acceptors39
Rotatable Bonds25
Heavy Atoms134
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001828.83
LogP ≤ 57.56
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1039

Analyze N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 158538429) is N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CNc1cc(Nc2cc(C)cn(-c3cnn(C)c3)c2=O)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cc(F)cn(-c3ccc(C)nn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.CNc1cc(Nc2cc(F)cn(-c3ccccn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.CNc1cc(Nc2cccn(-c3ccc(C4CC4)nn3)c2=O)nc2c(C(=O)N[C@H]3C[C@H]3F)cnn12.
What is the InChIKey of N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is HOFKXDNYQJOYPK-MTJQONQMSA-N. The full InChI is InChI=1S/C23H22FN9O2.C21H19F2N9O2.C21H18F2N8O2.C21H23N9O2/c1-25-20-10-18(29-21-13(11-26-33(20)21)22(34)28-17-9-14(17)24)27-16-3-2-8-32(23(16)35)19-7-6-15(30-31-19)12-4-5-12;1-10-3-4-17(30-29-10)31-9-11(22)5-15(21(31)34)26-16-7-18(24-2)32-19(28-16)12(8-25-32)20(33)27-14-6-13(14)23;1-24-18-8-16(29-19-12(9-26-31(18)19)20(32)28-14-7-13(14)23)27-15-6-11(22)10-30(21(15)33)17-4-2-3-5-25-17;1-12-6-16(21(32)29(10-12)14-8-23-28(3)11-14)26-17-7-18(22-2)30-19(27-17)15(9-24-30)20(31)25-13-4-5-13/h2-3,6-8,10-12,14,17,25H,4-5,9H2,1H3,(H,27,29)(H,28,34);3-5,7-9,13-14,24H,6H2,1-2H3,(H,26,28)(H,27,33);2-6,8-10,13-14,24H,7H2,1H3,(H,27,29)(H,28,32);6-11,13,22H,4-5H2,1-3H3,(H,25,31)(H,26,27)/t14-,17+;2*13-,14+;/m111./s1.
What are the key properties of N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1828.83 g/mol, XLogP of 7.56, 25 rotatable bonds, 12 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-7-(methylamino)-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[[1-(6-cyclopropylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-N-[(1S,2R)-2-fluorocyclopropyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[[5-fluoro-1-(6-methylpyridazin-3-yl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2R)-2-fluorocyclopropyl]-5-[(5-fluoro-2-oxo-1-pyridin-2-yl-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 158538429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).