4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone

C120H95F6N7O6S6 — CID 159201044

About 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone

4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone (PubChem CID 159201044) has the molecular formula C120H95F6N7O6S6 and a molecular weight of 2037.51 g/mol. Its IUPAC name is 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone.

Molecular Properties

• Compound Name: 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone
• PubChem CID: 159201044
• Molecular Formula: C120H95F6N7O6S6
• Molecular Weight: 2037.51 g/mol
• Exact Mass: 2035.56
• IUPAC Name: 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone
• SMILES: CC(=O)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.CCCCC(=O)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.CCCCCc1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.O=C(c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1)N1CCCCC1.O=C(c1ccccc1)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.O=C(c1ccco1)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1
• InChI: InChI=1S/C22H14FNOS.C21H19FN2OS.C20H12FNO2S.C20H18FNOS.C20H20FNS.C17H12FNOS/c23-18-8-6-17(7-9-18)22-19(15-10-12-24-13-11-15)14-20(26-22)21(25)16-4-2-1-3-5-16;22-17-6-4-16(5-7-17)20-18(15-8-10-23-11-9-15)14-19(26-20)21(25)24-12-2-1-3-13-24;21-15-5-3-14(4-6-15)20-16(13-7-9-22-10-8-13)12-18(25-20)19(23)17-2-1-11-24-17;1-2-3-4-18(23)19-13-17(14-9-11-22-12-10-14)20(24-19)15-5-7-16(21)8-6-15;1-2-3-4-5-18-14-19(15-10-12-22-13-11-15)20(23-18)16-6-8-17(21)9-7-16;1-11(20)16-10-15(12-6-8-19-9-7-12)17(21-16)13-2-4-14(18)5-3-13/h1-14H;4-11,14H,1-3,12-13H2;1-12H;5-13H,2-4H2,1H3;6-14H,2-5H2,1H3;2-10H,1H3
• InChIKey: KPHHQKOFFVXYNL-UHFFFAOYSA-N
• XLogP: 33.69
• TPSA: 179.07 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 26
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2037.51
LogP ≤ 5	33.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone?

The IUPAC name of 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone (CID 159201044) is 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone.

What is the SMILES notation for 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone?

The canonical SMILES for 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone is CC(=O)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.CCCCC(=O)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.CCCCCc1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.O=C(c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1)N1CCCCC1.O=C(c1ccccc1)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.O=C(c1ccco1)c1cc(-c2ccncc2)c(-c2ccc(F)cc2)s1.

What is the InChIKey of 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone?

The InChIKey is KPHHQKOFFVXYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14FNOS.C21H19FN2OS.C20H12FNO2S.C20H18FNOS.C20H20FNS.C17H12FNOS/c23-18-8-6-17(7-9-18)22-19(15-10-12-24-13-11-15)14-20(26-22)21(25)16-4-2-1-3-5-16;22-17-6-4-16(5-7-17)20-18(15-8-10-23-11-9-15)14-19(26-20)21(25)24-12-2-1-3-13-24;21-15-5-3-14(4-6-15)20-16(13-7-9-22-10-8-13)12-18(25-20)19(23)17-2-1-11-24-17;1-2-3-4-18(23)19-13-17(14-9-11-22-12-10-14)20(24-19)15-5-7-16(21)8-6-15;1-2-3-4-5-18-14-19(15-10-12-22-13-11-15)20(23-18)16-6-8-17(21)9-7-16;1-11(20)16-10-15(12-6-8-19-9-7-12)17(21-16)13-2-4-14(18)5-3-13/h1-14H;4-11,14H,1-3,12-13H2;1-12H;5-13H,2-4H2,1H3;6-14H,2-5H2,1H3;2-10H,1H3.

What are the key properties of 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone?

4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone has a molecular weight of 2037.51 g/mol, XLogP of 33.69, 26 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(4-fluorophenyl)-5-pentylthiophen-3-yl]pyridine;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]ethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-(furan-2-yl)methanone;1-[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]pentan-1-one;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-phenylmethanone;[5-(4-fluorophenyl)-4-pyridin-4-ylthiophen-2-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 159201044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).