N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine

C70H73F7N22O3 — CID 157355848

About N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine

N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 157355848) has the molecular formula C70H73F7N22O3 and a molecular weight of 1403.49 g/mol. Its IUPAC name is N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

• Compound Name: N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine
• PubChem CID: 157355848
• Molecular Formula: C70H73F7N22O3
• Molecular Weight: 1403.49 g/mol
• Exact Mass: 1402.61
• IUPAC Name: N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine
• SMILES: Cc1cc(C)n2nc(CC(=O)N(Cc3ccc(F)cc3)C3CC3)nc2n1.Cc1cc(C)n2nc(CC(=O)N(Cc3ccccc3F)C3CC3)nc2n1.Cc1cc(C2CCCN2c2cc(C(C)(F)F)nc3ncnn23)no1.Cc1cc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)n2ncnc2n1
• InChI: InChI=1S/2C19H20FN5O.C17H17F3N6.C15H16F2N6O/c1-12-9-13(2)25-19(21-12)22-17(23-25)10-18(26)24(16-7-8-16)11-14-3-5-15(20)6-4-14;1-12-9-13(2)25-19(21-12)22-17(23-25)10-18(26)24(15-7-8-15)11-14-5-3-4-6-16(14)20;1-12-9-15(26-16(23-12)21-11-22-26)25-7-5-24(6-8-25)14-4-2-3-13(10-14)17(18,19)20;1-9-6-10(21-24-9)11-4-3-5-22(11)13-7-12(15(2,16)17)20-14-18-8-19-23(13)14/h3-6,9,16H,7-8,10-11H2,1-2H3;3-6,9,15H,7-8,10-11H2,1-2H3;2-4,9-11H,5-8H2,1H3;6-8,11H,3-5H2,1-2H3
• InChIKey: BIBNFVPUBOADRO-UHFFFAOYSA-N
• XLogP: 10.88
• TPSA: 248.69 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 15
• Heavy Atoms: 102
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1403.49
LogP ≤ 5	10.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine?

The IUPAC name of N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine (CID 157355848) is N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine.

What is the SMILES notation for N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine?

The canonical SMILES for N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine is Cc1cc(C)n2nc(CC(=O)N(Cc3ccc(F)cc3)C3CC3)nc2n1.Cc1cc(C)n2nc(CC(=O)N(Cc3ccccc3F)C3CC3)nc2n1.Cc1cc(C2CCCN2c2cc(C(C)(F)F)nc3ncnn23)no1.Cc1cc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)n2ncnc2n1.

What is the InChIKey of N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine?

The InChIKey is BIBNFVPUBOADRO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H20FN5O.C17H17F3N6.C15H16F2N6O/c1-12-9-13(2)25-19(21-12)22-17(23-25)10-18(26)24(16-7-8-16)11-14-3-5-15(20)6-4-14;1-12-9-13(2)25-19(21-12)22-17(23-25)10-18(26)24(15-7-8-15)11-14-5-3-4-6-16(14)20;1-12-9-15(26-16(23-12)21-11-22-26)25-7-5-24(6-8-25)14-4-2-3-13(10-14)17(18,19)20;1-9-6-10(21-24-9)11-4-3-5-22(11)13-7-12(15(2,16)17)20-14-18-8-19-23(13)14/h3-6,9,16H,7-8,10-11H2,1-2H3;3-6,9,15H,7-8,10-11H2,1-2H3;2-4,9-11H,5-8H2,1H3;6-8,11H,3-5H2,1-2H3.

What are the key properties of N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine?

N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 1403.49 g/mol, XLogP of 10.88, 15 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(2-fluorophenyl)methyl]acetamide;N-cyclopropyl-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-fluorophenyl)methyl]acetamide;3-[1-[5-(1,1-difluoroethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]-5-methyl-1,2-oxazole;5-methyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 157355848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).