5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride

C72H75Cl2F16N27O9 — CID 172962487

About 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride

5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride (PubChem CID 172962487) has the molecular formula C72H75Cl2F16N27O9 and a molecular weight of 1837.45 g/mol. Its IUPAC name is 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride.

Molecular Properties

• Compound Name: 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride
• PubChem CID: 172962487
• Molecular Formula: C72H75Cl2F16N27O9
• Molecular Weight: 1837.45 g/mol
• Exact Mass: 1835.54
• IUPAC Name: 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride
• SMILES: COC(C)(C)OC.C[C@@H](N)c1cc(F)cnc1OCC(F)(F)F.C[C@@H](Nc1ccn2ncc(/C(N)=N/O)c2n1)c1cc(F)cnc1OCC(F)(F)F.C[C@@H](Nc1ccn2ncc(C#N)c2n1)c1cc(F)cnc1OCC(F)(F)F.C[C@@H](Nc1ccn2ncc(C3=NC(C)(C)ON3)c2n1)c1cc(F)cnc1OCC(F)(F)F.Cl.N#Cc1cnn2ccc(Cl)nc12.NO
• InChI: InChI=1S/C19H19F4N7O2.C16H15F4N7O2.C16H12F4N6O.C9H10F4N2O.C7H3ClN4.C5H12O2.ClH.H3NO/c1-10(12-6-11(20)7-24-17(12)31-9-19(21,22)23)26-14-4-5-30-16(27-14)13(8-25-30)15-28-18(2,3)32-29-15;1-8(10-4-9(17)5-22-15(10)29-7-16(18,19)20)24-12-2-3-27-14(25-12)11(6-23-27)13(21)26-28;1-9(12-4-11(17)7-22-15(12)27-8-16(18,19)20)24-13-2-3-26-14(25-13)10(5-21)6-23-26;1-5(14)7-2-6(10)3-15-8(7)16-4-9(11,12)13;8-6-1-2-12-7(11-6)5(3-9)4-10-12;1-5(2,6-3)7-4;;1-2/h4-8,10H,9H2,1-3H3,(H,26,27)(H,28,29);2-6,8,28H,7H2,1H3,(H2,21,26)(H,24,25);2-4,6-7,9H,8H2,1H3,(H,24,25);2-3,5H,4,14H2,1H3;1-2,4H;1-4H3;1H;2H,1H2/t10-;8-;9-;5-;;;;/m1111..../s1
• InChIKey: HRDMABJYSYFNHB-XDQDZZDISA-N
• XLogP: 13.32
• TPSA: 475.87 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 35
• Rotatable Bonds: 22
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1837.45
LogP ≤ 5	13.32
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride?

The IUPAC name of 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride (CID 172962487) is 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride.

What is the SMILES notation for 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride?

The canonical SMILES for 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride is COC(C)(C)OC.C[C@@H](N)c1cc(F)cnc1OCC(F)(F)F.C[C@@H](Nc1ccn2ncc(/C(N)=N/O)c2n1)c1cc(F)cnc1OCC(F)(F)F.C[C@@H](Nc1ccn2ncc(C#N)c2n1)c1cc(F)cnc1OCC(F)(F)F.C[C@@H](Nc1ccn2ncc(C3=NC(C)(C)ON3)c2n1)c1cc(F)cnc1OCC(F)(F)F.Cl.N#Cc1cnn2ccc(Cl)nc12.NO.

What is the InChIKey of 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride?

The InChIKey is HRDMABJYSYFNHB-XDQDZZDISA-N. The full InChI is InChI=1S/C19H19F4N7O2.C16H15F4N7O2.C16H12F4N6O.C9H10F4N2O.C7H3ClN4.C5H12O2.ClH.H3NO/c1-10(12-6-11(20)7-24-17(12)31-9-19(21,22)23)26-14-4-5-30-16(27-14)13(8-25-30)15-28-18(2,3)32-29-15;1-8(10-4-9(17)5-22-15(10)29-7-16(18,19)20)24-12-2-3-27-14(25-12)11(6-23-27)13(21)26-28;1-9(12-4-11(17)7-22-15(12)27-8-16(18,19)20)24-13-2-3-26-14(25-13)10(5-21)6-23-26;1-5(14)7-2-6(10)3-15-8(7)16-4-9(11,12)13;8-6-1-2-12-7(11-6)5(3-9)4-10-12;1-5(2,6-3)7-4;;1-2/h4-8,10H,9H2,1-3H3,(H,26,27)(H,28,29);2-6,8,28H,7H2,1H3,(H2,21,26)(H,24,25);2-4,6-7,9H,8H2,1H3,(H,24,25);2-3,5H,4,14H2,1H3;1-2,4H;1-4H3;1H;2H,1H2/t10-;8-;9-;5-;;;;/m1111..../s1.

What are the key properties of 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride?

5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride has a molecular weight of 1837.45 g/mol, XLogP of 13.32, 22 rotatable bonds, 9 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2,2-dimethoxypropane;3-(5,5-dimethyl-2H-1,2,4-oxadiazol-3-yl)-N-[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine;(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethanamine;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]-N'-hydroxypyrazolo[1,5-a]pyrimidine-3-carboximidamide;5-[[(1R)-1-[5-fluoro-2-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]amino]pyrazolo[1,5-a]pyrimidine-3-carbonitrile;hydroxylamine;hydrochloride is sourced from PubChem (CID 172962487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).