N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide

C83H69F5N22O6S5 — CID 160959708

About N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide

N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 160959708) has the molecular formula C83H69F5N22O6S5 and a molecular weight of 1725.94 g/mol. Its IUPAC name is N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

• Compound Name: N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide
• PubChem CID: 160959708
• Molecular Formula: C83H69F5N22O6S5
• Molecular Weight: 1725.94 g/mol
• Exact Mass: 1724.43
• IUPAC Name: N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide
• SMILES: COc1nccc(-c2csc(NC(=O)Cc3ccccc3F)n2)n1.O=C(Cc1ccc(F)cc1)Nc1nc(-c2ccncn2)cs1.O=C(Cc1ccccc1F)Nc1nc(-c2ccnc(NC3CC3)n2)cs1.O=C(Cc1ccccc1F)Nc1nc(-c2ccnc(NCC3CC3)n2)cs1.O=C(Cc1ccccc1F)Nc1nc(-c2ccncn2)cs1
• InChI: InChI=1S/C19H18FN5OS.C18H16FN5OS.C16H13FN4O2S.2C15H11FN4OS/c20-14-4-2-1-3-13(14)9-17(26)25-19-24-16(11-27-19)15-7-8-21-18(23-15)22-10-12-5-6-12;19-13-4-2-1-3-11(13)9-16(25)24-18-23-15(10-26-18)14-7-8-20-17(22-14)21-12-5-6-12;1-23-15-18-7-6-12(19-15)13-9-24-16(20-13)21-14(22)8-10-4-2-3-5-11(10)17;16-11-3-1-10(2-4-11)7-14(21)20-15-19-13(8-22-15)12-5-6-17-9-18-12;16-11-4-2-1-3-10(11)7-14(21)20-15-19-13(8-22-15)12-5-6-17-9-18-12/h1-4,7-8,11-12H,5-6,9-10H2,(H,21,22,23)(H,24,25,26);1-4,7-8,10,12H,5-6,9H2,(H,20,21,22)(H,23,24,25);2-7,9H,8H2,1H3,(H,20,21,22);2*1-6,8-9H,7H2,(H,19,20,21)
• InChIKey: SWVWDMPQRMDFRQ-UHFFFAOYSA-N
• XLogP: 16.01
• TPSA: 372.14 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 28
• Rotatable Bonds: 26
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1725.94
LogP ≤ 5	16.01
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide?

The IUPAC name of N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide (CID 160959708) is N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide.

What is the SMILES notation for N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide?

The canonical SMILES for N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide is COc1nccc(-c2csc(NC(=O)Cc3ccccc3F)n2)n1.O=C(Cc1ccc(F)cc1)Nc1nc(-c2ccncn2)cs1.O=C(Cc1ccccc1F)Nc1nc(-c2ccnc(NC3CC3)n2)cs1.O=C(Cc1ccccc1F)Nc1nc(-c2ccnc(NCC3CC3)n2)cs1.O=C(Cc1ccccc1F)Nc1nc(-c2ccncn2)cs1.

What is the InChIKey of N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide?

The InChIKey is SWVWDMPQRMDFRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN5OS.C18H16FN5OS.C16H13FN4O2S.2C15H11FN4OS/c20-14-4-2-1-3-13(14)9-17(26)25-19-24-16(11-27-19)15-7-8-21-18(23-15)22-10-12-5-6-12;19-13-4-2-1-3-11(13)9-16(25)24-18-23-15(10-26-18)14-7-8-20-17(22-14)21-12-5-6-12;1-23-15-18-7-6-12(19-15)13-9-24-16(20-13)21-14(22)8-10-4-2-3-5-11(10)17;16-11-3-1-10(2-4-11)7-14(21)20-15-19-13(8-22-15)12-5-6-17-9-18-12;16-11-4-2-1-3-10(11)7-14(21)20-15-19-13(8-22-15)12-5-6-17-9-18-12/h1-4,7-8,11-12H,5-6,9-10H2,(H,21,22,23)(H,24,25,26);1-4,7-8,10,12H,5-6,9H2,(H,20,21,22)(H,23,24,25);2-7,9H,8H2,1H3,(H,20,21,22);2*1-6,8-9H,7H2,(H,19,20,21).

What are the key properties of N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide?

N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 1725.94 g/mol, XLogP of 16.01, 26 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[2-(cyclopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;N-[4-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-2-(2-fluorophenyl)acetamide;2-(2-fluorophenyl)-N-[4-(2-methoxypyrimidin-4-yl)-1,3-thiazol-2-yl]acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 160959708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).