2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide

C96H92F3N31O11S — CID 157069358

About 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide

2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide (PubChem CID 157069358) has the molecular formula C96H92F3N31O11S and a molecular weight of 1945.06 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide.

Molecular Properties

• Compound Name: 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
• PubChem CID: 157069358
• Molecular Formula: C96H92F3N31O11S
• Molecular Weight: 1945.06 g/mol
• Exact Mass: 1943.73
• IUPAC Name: 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
• SMILES: CC(C)CCS(=O)(=O)CC(=O)Nc1n[nH]c(-c2ccccn2)n1.CCc1ccc(OCC(=O)Nc2n[nH]c(-c3ccccn3)n2)cc1.O=C(CCc1ccccc1F)Nc1n[nH]c(-c2ccccn2)n1.O=C(COCC1CC1)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1cccc(C(=O)Nc2n[nH]c(-c3ccccn3)n2)c1)c1cccnc1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C(F)(F)c1ccccc1
• InChI: InChI=1S/C21H16N6O2.C17H17N5O2.C16H14FN5O.C15H11F2N5O.C14H19N5O3S.C13H15N5O2/c28-18(16-7-4-9-22-13-16)12-14-5-3-6-15(11-14)20(29)25-21-24-19(26-27-21)17-8-1-2-10-23-17;1-2-12-6-8-13(9-7-12)24-11-15(23)19-17-20-16(21-22-17)14-5-3-4-10-18-14;17-12-6-2-1-5-11(12)8-9-14(23)19-16-20-15(21-22-16)13-7-3-4-10-18-13;16-15(17,10-6-2-1-3-7-10)13(23)20-14-19-12(21-22-14)11-8-4-5-9-18-11;1-10(2)6-8-23(21,22)9-12(20)16-14-17-13(18-19-14)11-5-3-4-7-15-11;19-11(8-20-7-9-4-5-9)15-13-16-12(17-18-13)10-3-1-2-6-14-10/h1-11,13H,12H2,(H2,24,25,26,27,29);3-10H,2,11H2,1H3,(H2,19,20,21,22,23);1-7,10H,8-9H2,(H2,19,20,21,22,23);1-9H,(H2,19,20,21,22,23);3-5,7,10H,6,8-9H2,1-2H3,(H2,16,17,18,19,20);1-3,6,9H,4-5,7-8H2,(H2,15,16,17,18,19)
• InChIKey: ACFZLHWBISYEJX-UHFFFAOYSA-N
• XLogP: 13.06
• TPSA: 583.92 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 30
• Rotatable Bonds: 34
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1945.06
LogP ≤ 5	13.06
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?

The IUPAC name of 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide (CID 157069358) is 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide.

What is the SMILES notation for 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?

The canonical SMILES for 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide is CC(C)CCS(=O)(=O)CC(=O)Nc1n[nH]c(-c2ccccn2)n1.CCc1ccc(OCC(=O)Nc2n[nH]c(-c3ccccn3)n2)cc1.O=C(CCc1ccccc1F)Nc1n[nH]c(-c2ccccn2)n1.O=C(COCC1CC1)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1cccc(C(=O)Nc2n[nH]c(-c3ccccn3)n2)c1)c1cccnc1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C(F)(F)c1ccccc1.

What is the InChIKey of 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?

The InChIKey is ACFZLHWBISYEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N6O2.C17H17N5O2.C16H14FN5O.C15H11F2N5O.C14H19N5O3S.C13H15N5O2/c28-18(16-7-4-9-22-13-16)12-14-5-3-6-15(11-14)20(29)25-21-24-19(26-27-21)17-8-1-2-10-23-17;1-2-12-6-8-13(9-7-12)24-11-15(23)19-17-20-16(21-22-17)14-5-3-4-10-18-14;17-12-6-2-1-5-11(12)8-9-14(23)19-16-20-15(21-22-16)13-7-3-4-10-18-13;16-15(17,10-6-2-1-3-7-10)13(23)20-14-19-12(21-22-14)11-8-4-5-9-18-11;1-10(2)6-8-23(21,22)9-12(20)16-14-17-13(18-19-14)11-5-3-4-7-15-11;19-11(8-20-7-9-4-5-9)15-13-16-12(17-18-13)10-3-1-2-6-14-10/h1-11,13H,12H2,(H2,24,25,26,27,29);3-10H,2,11H2,1H3,(H2,19,20,21,22,23);1-7,10H,8-9H2,(H2,19,20,21,22,23);1-9H,(H2,19,20,21,22,23);3-5,7,10H,6,8-9H2,1-2H3,(H2,16,17,18,19,20);1-3,6,9H,4-5,7-8H2,(H2,15,16,17,18,19).

What are the key properties of 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?

2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide has a molecular weight of 1945.06 g/mol, XLogP of 13.06, 34 rotatable bonds, 12 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(cyclopropylmethoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2,2-difluoro-2-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;2-(4-ethylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-(3-methylbutylsulfonyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-(2-oxo-2-pyridin-3-ylethyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide is sourced from PubChem (CID 157069358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).