4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole

C101H111F7N14O5S7 — CID 159322680

About 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole

4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole (PubChem CID 159322680) has the molecular formula C101H111F7N14O5S7 and a molecular weight of 1958.55 g/mol. Its IUPAC name is 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole.

Molecular Properties

• Compound Name: 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole
• PubChem CID: 159322680
• Molecular Formula: C101H111F7N14O5S7
• Molecular Weight: 1958.55 g/mol
• Exact Mass: 1956.68
• IUPAC Name: 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole
• SMILES: COc1c(-c2csc(N3CCCCC3)n2)ccc(F)c1F.COc1cc(F)ccc1-c1csc(N2CCCCC2)n1.Cc1sc(N2CCCCC2)nc1-c1ccccc1.Oc1c(-c2csc(N3CCCCC3)n2)ccc(F)c1F.Oc1c(F)cccc1-c1csc(N2CCCCC2)n1.Oc1cc(F)ccc1-c1csc(N2CCCCC2)n1.c1ccc(-c2csc(N3CCCCC3)n2)cc1
• InChI: InChI=1S/C15H16F2N2OS.C15H17FN2OS.C15H18N2S.C14H14F2N2OS.2C14H15FN2OS.C14H16N2S/c1-20-14-10(5-6-11(16)13(14)17)12-9-21-15(18-12)19-7-3-2-4-8-19;1-19-14-9-11(16)5-6-12(14)13-10-20-15(17-13)18-7-3-2-4-8-18;1-12-14(13-8-4-2-5-9-13)16-15(18-12)17-10-6-3-7-11-17;15-10-5-4-9(13(19)12(10)16)11-8-20-14(17-11)18-6-2-1-3-7-18;15-11-6-4-5-10(13(11)18)12-9-19-14(16-12)17-7-2-1-3-8-17;15-10-4-5-11(13(18)8-10)12-9-19-14(16-12)17-6-2-1-3-7-17;1-3-7-12(8-4-1)13-11-17-14(15-13)16-9-5-2-6-10-16/h5-6,9H,2-4,7-8H2,1H3;5-6,9-10H,2-4,7-8H2,1H3;2,4-5,8-9H,3,6-7,10-11H2,1H3;4-5,8,19H,1-3,6-7H2;4-6,9,18H,1-3,7-8H2;4-5,8-9,18H,1-3,6-7H2;1,3-4,7-8,11H,2,5-6,9-10H2
• InChIKey: LDYUHGHYQOLYQW-UHFFFAOYSA-N
• XLogP: 27.02
• TPSA: 192.06 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 26
• Rotatable Bonds: 16
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1958.55
LogP ≤ 5	27.02
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole?

The IUPAC name of 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole (CID 159322680) is 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole.

What is the SMILES notation for 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole?

The canonical SMILES for 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole is COc1c(-c2csc(N3CCCCC3)n2)ccc(F)c1F.COc1cc(F)ccc1-c1csc(N2CCCCC2)n1.Cc1sc(N2CCCCC2)nc1-c1ccccc1.Oc1c(-c2csc(N3CCCCC3)n2)ccc(F)c1F.Oc1c(F)cccc1-c1csc(N2CCCCC2)n1.Oc1cc(F)ccc1-c1csc(N2CCCCC2)n1.c1ccc(-c2csc(N3CCCCC3)n2)cc1.

What is the InChIKey of 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole?

The InChIKey is LDYUHGHYQOLYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2OS.C15H17FN2OS.C15H18N2S.C14H14F2N2OS.2C14H15FN2OS.C14H16N2S/c1-20-14-10(5-6-11(16)13(14)17)12-9-21-15(18-12)19-7-3-2-4-8-19;1-19-14-9-11(16)5-6-12(14)13-10-20-15(17-13)18-7-3-2-4-8-18;1-12-14(13-8-4-2-5-9-13)16-15(18-12)17-10-6-3-7-11-17;15-10-5-4-9(13(19)12(10)16)11-8-20-14(17-11)18-6-2-1-3-7-18;15-11-6-4-5-10(13(11)18)12-9-19-14(16-12)17-7-2-1-3-8-17;15-10-4-5-11(13(18)8-10)12-9-19-14(16-12)17-6-2-1-3-7-17;1-3-7-12(8-4-1)13-11-17-14(15-13)16-9-5-2-6-10-16/h5-6,9H,2-4,7-8H2,1H3;5-6,9-10H,2-4,7-8H2,1H3;2,4-5,8-9H,3,6-7,10-11H2,1H3;4-5,8,19H,1-3,6-7H2;4-6,9,18H,1-3,7-8H2;4-5,8-9,18H,1-3,6-7H2;1,3-4,7-8,11H,2,5-6,9-10H2.

What are the key properties of 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole?

4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole has a molecular weight of 1958.55 g/mol, XLogP of 27.02, 16 rotatable bonds, 3 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3,4-difluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2,3-difluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;4-(4-fluoro-2-methoxyphenyl)-2-piperidin-1-yl-1,3-thiazole;2-fluoro-6-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-fluoro-2-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenol;5-methyl-4-phenyl-2-piperidin-1-yl-1,3-thiazole;4-phenyl-2-piperidin-1-yl-1,3-thiazole is sourced from PubChem (CID 159322680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).