2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine

C142H128Cl4F8N32O4 — CID 160912926

About 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine

2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine (PubChem CID 160912926) has the molecular formula C142H128Cl4F8N32O4 and a molecular weight of 2640.60 g/mol. Its IUPAC name is 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine.

Molecular Properties

• Compound Name: 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
• PubChem CID: 160912926
• Molecular Formula: C142H128Cl4F8N32O4
• Molecular Weight: 2640.60 g/mol
• Exact Mass: 2636.94
• IUPAC Name: 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
• SMILES: COc1ccc(Nc2ncc(F)c(Nc3ccc(OC)cc3)n2)cc1.COc1ccccc1Nc1ncc(F)c(Nc2ccccc2OC)n1.Cc1ccc(C)c(Nc2ncc(F)c(Nc3cc(C)ccc3C)n2)c1.Cc1ccc(Nc2ncc(F)c(Nc3ccc(C)c(C)c3)n2)cc1C.Cc1cccc(Nc2ncc(F)c(Nc3cccc(C)c3)n2)c1.Fc1cnc(Nc2cccc(Cl)c2)nc1Nc1cccc(Cl)c1.Fc1cnc(Nc2ccccc2)nc1Nc1ccccc1.Fc1cnc(Nc2ccccc2Cl)nc1Nc1ccccc1Cl
• InChI: InChI=1S/2C20H21FN4.2C18H17FN4O2.C18H17FN4.2C16H11Cl2FN4.C16H13FN4/c1-12-5-7-16(9-14(12)3)23-19-18(21)11-22-20(25-19)24-17-8-6-13(2)15(4)10-17;1-12-5-7-14(3)17(9-12)23-19-16(21)11-22-20(25-19)24-18-10-13(2)6-8-15(18)4;1-24-14-7-3-12(4-8-14)21-17-16(19)11-20-18(23-17)22-13-5-9-15(25-2)10-6-13;1-24-15-9-5-3-7-13(15)21-17-12(19)11-20-18(23-17)22-14-8-4-6-10-16(14)25-2;1-12-5-3-7-14(9-12)21-17-16(19)11-20-18(23-17)22-15-8-4-6-13(2)10-15;17-10-3-1-5-12(7-10)21-15-14(19)9-20-16(23-15)22-13-6-2-4-11(18)8-13;17-10-5-1-3-7-13(10)21-15-12(19)9-20-16(23-15)22-14-8-4-2-6-11(14)18;17-14-11-18-16(20-13-9-5-2-6-10-13)21-15(14)19-12-7-3-1-4-8-12/h2*5-11H,1-4H3,(H2,22,23,24,25);2*3-11H,1-2H3,(H2,20,21,22,23);3-11H,1-2H3,(H2,20,21,22,23);2*1-9H,(H2,20,21,22,23);1-11H,(H2,18,19,20,21)
• InChIKey: SRAHXTMNVWQRGN-UHFFFAOYSA-N
• XLogP: 38.56
• TPSA: 435.64 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 36
• Rotatable Bonds: 36
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2640.60
LogP ≤ 5	38.56
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	36

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?

The IUPAC name of 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine (CID 160912926) is 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine.

What is the SMILES notation for 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?

The canonical SMILES for 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine is COc1ccc(Nc2ncc(F)c(Nc3ccc(OC)cc3)n2)cc1.COc1ccccc1Nc1ncc(F)c(Nc2ccccc2OC)n1.Cc1ccc(C)c(Nc2ncc(F)c(Nc3cc(C)ccc3C)n2)c1.Cc1ccc(Nc2ncc(F)c(Nc3ccc(C)c(C)c3)n2)cc1C.Cc1cccc(Nc2ncc(F)c(Nc3cccc(C)c3)n2)c1.Fc1cnc(Nc2cccc(Cl)c2)nc1Nc1cccc(Cl)c1.Fc1cnc(Nc2ccccc2)nc1Nc1ccccc1.Fc1cnc(Nc2ccccc2Cl)nc1Nc1ccccc1Cl.

What is the InChIKey of 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?

The InChIKey is SRAHXTMNVWQRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H21FN4.2C18H17FN4O2.C18H17FN4.2C16H11Cl2FN4.C16H13FN4/c1-12-5-7-16(9-14(12)3)23-19-18(21)11-22-20(25-19)24-17-8-6-13(2)15(4)10-17;1-12-5-7-14(3)17(9-12)23-19-16(21)11-22-20(25-19)24-18-10-13(2)6-8-15(18)4;1-24-14-7-3-12(4-8-14)21-17-16(19)11-20-18(23-17)22-13-5-9-15(25-2)10-6-13;1-24-15-9-5-3-7-13(15)21-17-12(19)11-20-18(23-17)22-14-8-4-6-10-16(14)25-2;1-12-5-3-7-14(9-12)21-17-16(19)11-20-18(23-17)22-15-8-4-6-13(2)10-15;17-10-3-1-5-12(7-10)21-15-14(19)9-20-16(23-15)22-13-6-2-4-11(18)8-13;17-10-5-1-3-7-13(10)21-15-12(19)9-20-16(23-15)22-14-8-4-2-6-11(14)18;17-14-11-18-16(20-13-9-5-2-6-10-13)21-15(14)19-12-7-3-1-4-8-12/h2*5-11H,1-4H3,(H2,22,23,24,25);2*3-11H,1-2H3,(H2,20,21,22,23);3-11H,1-2H3,(H2,20,21,22,23);2*1-9H,(H2,20,21,22,23);1-11H,(H2,18,19,20,21).

What are the key properties of 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine?

2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine has a molecular weight of 2640.60 g/mol, XLogP of 38.56, 36 rotatable bonds, 16 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine is sourced from PubChem (CID 160912926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).