6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine

C64H65Cl5F7N19O — CID 161074343

About 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine

6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine (PubChem CID 161074343) has the molecular formula C64H65Cl5F7N19O and a molecular weight of 1426.61 g/mol. Its IUPAC name is 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine.

Molecular Properties

• Compound Name: 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine
• PubChem CID: 161074343
• Molecular Formula: C64H65Cl5F7N19O
• Molecular Weight: 1426.61 g/mol
• Exact Mass: 1423.40
• IUPAC Name: 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine
• SMILES: CCc1cc(-c2cc(C(F)(F)F)ccc2C)nc(N)n1.CNc1cc(-c2cc(C)c(F)cc2C)nc(N)n1.CNc1cc(-c2cc(Cl)c(C(F)(F)F)cc2C)nc(N)n1.CNc1cc(-c2cc(Cl)c(Cl)cc2C)nc(N)n1.CNc1cc(-c2cc(Cl)c(OC)cc2Cl)nc(N)n1
• InChI: InChI=1S/C14H14F3N3.C13H12ClF3N4.C13H15FN4.C12H12Cl2N4O.C12H12Cl2N4/c1-3-10-7-12(20-13(18)19-10)11-6-9(14(15,16)17)5-4-8(11)2;1-6-3-8(13(15,16)17)9(14)4-7(6)10-5-11(19-2)21-12(18)20-10;1-7-5-10(14)8(2)4-9(7)11-6-12(16-3)18-13(15)17-11;1-16-11-5-9(17-12(15)18-11)6-3-8(14)10(19-2)4-7(6)13;1-6-3-8(13)9(14)4-7(6)10-5-11(16-2)18-12(15)17-10/h4-7H,3H2,1-2H3,(H2,18,19,20);3-5H,1-2H3,(H3,18,19,20,21);4-6H,1-3H3,(H3,15,16,17,18);3-5H,1-2H3,(H3,15,16,17,18);3-5H,1-2H3,(H3,15,16,17,18)
• InChIKey: UFBIDPLXGILJBF-UHFFFAOYSA-N
• XLogP: 16.35
• TPSA: 316.35 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 20
• Rotatable Bonds: 11
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1426.61
LogP ≤ 5	16.35
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine?

The IUPAC name of 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine (CID 161074343) is 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine.

What is the SMILES notation for 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine?

The canonical SMILES for 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine is CCc1cc(-c2cc(C(F)(F)F)ccc2C)nc(N)n1.CNc1cc(-c2cc(C)c(F)cc2C)nc(N)n1.CNc1cc(-c2cc(Cl)c(C(F)(F)F)cc2C)nc(N)n1.CNc1cc(-c2cc(Cl)c(Cl)cc2C)nc(N)n1.CNc1cc(-c2cc(Cl)c(OC)cc2Cl)nc(N)n1.

What is the InChIKey of 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine?

The InChIKey is UFBIDPLXGILJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3.C13H12ClF3N4.C13H15FN4.C12H12Cl2N4O.C12H12Cl2N4/c1-3-10-7-12(20-13(18)19-10)11-6-9(14(15,16)17)5-4-8(11)2;1-6-3-8(13(15,16)17)9(14)4-7(6)10-5-11(19-2)21-12(18)20-10;1-7-5-10(14)8(2)4-9(7)11-6-12(16-3)18-13(15)17-11;1-16-11-5-9(17-12(15)18-11)6-3-8(14)10(19-2)4-7(6)13;1-6-3-8(13)9(14)4-7(6)10-5-11(16-2)18-12(15)17-10/h4-7H,3H2,1-2H3,(H2,18,19,20);3-5H,1-2H3,(H3,18,19,20,21);4-6H,1-3H3,(H3,15,16,17,18);3-5H,1-2H3,(H3,15,16,17,18);3-5H,1-2H3,(H3,15,16,17,18).

What are the key properties of 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine?

6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine has a molecular weight of 1426.61 g/mol, XLogP of 16.35, 11 rotatable bonds, 9 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[5-chloro-2-methyl-4-(trifluoromethyl)phenyl]-4-N-methylpyrimidine-2,4-diamine;6-(2,5-dichloro-4-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine;6-(4,5-dichloro-2-methylphenyl)-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-[2-methyl-5-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(4-fluoro-2,5-dimethylphenyl)-4-N-methylpyrimidine-2,4-diamine is sourced from PubChem (CID 161074343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).