5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide

C121H106Cl3F8N45O10 — CID 159222788

About 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide

5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide (PubChem CID 159222788) has the molecular formula C121H106Cl3F8N45O10 and a molecular weight of 2608.83 g/mol. Its IUPAC name is 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide.

Molecular Properties

• Compound Name: 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide
• PubChem CID: 159222788
• Molecular Formula: C121H106Cl3F8N45O10
• Molecular Weight: 2608.83 g/mol
• Exact Mass: 2605.81
• IUPAC Name: 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide
• SMILES: O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cccnn3)cc2Cl)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3ccncn3)c(Cl)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cncnc3)c(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cncnc3)c(Cl)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cncnc3)cc2)cn1
• InChI: InChI=1S/C25H21F4N9O2.3C24H21ClFN9O2.C24H22FN9O2/c26-20-13-33-24(35-22(20)38-5-7-40-8-6-38)37-36-23(39)21-4-2-17(12-32-21)34-16-1-3-18(15-10-30-14-31-11-15)19(9-16)25(27,28)29;25-19-9-16(1-3-18(19)15-10-27-14-28-11-15)31-17-2-4-21(29-12-17)23(36)33-34-24-30-13-20(26)22(32-24)35-5-7-37-8-6-35;25-18-11-15(1-3-17(18)20-5-6-27-14-30-20)31-16-2-4-21(28-12-16)23(36)33-34-24-29-13-19(26)22(32-24)35-7-9-37-10-8-35;25-17-12-15(19-2-1-7-29-32-19)3-5-20(17)30-16-4-6-21(27-13-16)23(36)33-34-24-28-14-18(26)22(31-24)35-8-10-37-11-9-35;25-20-14-29-24(31-22(20)34-7-9-36-10-8-34)33-32-23(35)21-6-5-19(13-28-21)30-18-3-1-16(2-4-18)17-11-26-15-27-12-17/h1-4,9-14,34H,5-8H2,(H,36,39)(H,33,35,37);1-4,9-14,31H,5-8H2,(H,33,36)(H,30,32,34);1-6,11-14,31H,7-10H2,(H,33,36)(H,29,32,34);1-7,12-14,30H,8-11H2,(H,33,36)(H,28,31,34);1-6,11-15,30H,7-10H2,(H,32,35)(H,29,31,33)
• InChIKey: KRXGLPXAPFVBBM-UHFFFAOYSA-N
• XLogP: 17.00
• TPSA: 650.40 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 50
• Rotatable Bonds: 35
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2608.83
LogP ≤ 5	17.00
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide?

The IUPAC name of 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide (CID 159222788) is 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide.

What is the SMILES notation for 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide?

The canonical SMILES for 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide is O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cccnn3)cc2Cl)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3ccncn3)c(Cl)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cncnc3)c(C(F)(F)F)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cncnc3)c(Cl)c2)cn1.O=C(NNc1ncc(F)c(N2CCOCC2)n1)c1ccc(Nc2ccc(-c3cncnc3)cc2)cn1.

What is the InChIKey of 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide?

The InChIKey is KRXGLPXAPFVBBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21F4N9O2.3C24H21ClFN9O2.C24H22FN9O2/c26-20-13-33-24(35-22(20)38-5-7-40-8-6-38)37-36-23(39)21-4-2-17(12-32-21)34-16-1-3-18(15-10-30-14-31-11-15)19(9-16)25(27,28)29;25-19-9-16(1-3-18(19)15-10-27-14-28-11-15)31-17-2-4-21(29-12-17)23(36)33-34-24-30-13-20(26)22(32-24)35-5-7-37-8-6-35;25-18-11-15(1-3-17(18)20-5-6-27-14-30-20)31-16-2-4-21(28-12-16)23(36)33-34-24-29-13-19(26)22(32-24)35-7-9-37-10-8-35;25-17-12-15(19-2-1-7-29-32-19)3-5-20(17)30-16-4-6-21(27-13-16)23(36)33-34-24-28-14-18(26)22(31-24)35-8-10-37-11-9-35;25-20-14-29-24(31-22(20)34-7-9-36-10-8-34)33-32-23(35)21-6-5-19(13-28-21)30-18-3-1-16(2-4-18)17-11-26-15-27-12-17/h1-4,9-14,34H,5-8H2,(H,36,39)(H,33,35,37);1-4,9-14,31H,5-8H2,(H,33,36)(H,30,32,34);1-6,11-14,31H,7-10H2,(H,33,36)(H,29,32,34);1-7,12-14,30H,8-11H2,(H,33,36)(H,28,31,34);1-6,11-15,30H,7-10H2,(H,32,35)(H,29,31,33).

What are the key properties of 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide?

5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide has a molecular weight of 2608.83 g/mol, XLogP of 17.00, 35 rotatable bonds, 15 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2-chloro-4-pyridazin-3-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-4-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;5-(3-chloro-4-pyrimidin-5-ylanilino)-N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-(4-pyrimidin-5-ylanilino)pyridine-2-carbohydrazide;N'-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-5-[4-pyrimidin-5-yl-3-(trifluoromethyl)anilino]pyridine-2-carbohydrazide is sourced from PubChem (CID 159222788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).