[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine

C109H105Cl10F5N18O10 — CID 158575845

About [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine

[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine (PubChem CID 158575845) has the molecular formula C109H105Cl10F5N18O10 and a molecular weight of 2276.67 g/mol. Its IUPAC name is [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine.

Molecular Properties

• Compound Name: [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine
• PubChem CID: 158575845
• Molecular Formula: C109H105Cl10F5N18O10
• Molecular Weight: 2276.67 g/mol
• Exact Mass: 2270.51
• IUPAC Name: [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine
• SMILES: CC(Oc1cc(-c2ccc(C3(O)CCNCC3)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(CO)cn2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(CO)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(OC3CCNCC3)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(OCCC3CCNCC3)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl
• InChI: InChI=1S/C25H27Cl2FN4O2.2C23H23Cl2FN4O2.2C19H16Cl2FN3O2/c1-15(23-19(26)3-4-20(28)24(23)27)34-21-12-18(14-32-25(21)29)17-2-5-22(31-13-17)33-11-8-16-6-9-30-10-7-16;1-13(21-17(24)3-4-18(26)22(21)25)31-19-10-15(12-30-23(19)27)14-2-5-20(29-11-14)32-16-6-8-28-9-7-16;1-13(20-16(24)3-4-17(26)21(20)25)32-18-10-15(12-30-22(18)27)14-2-5-19(29-11-14)23(31)6-8-28-9-7-23;1-10(17-13(20)3-4-14(22)18(17)21)27-16-6-12(8-25-19(16)23)15-5-2-11(9-26)7-24-15;1-10(17-14(20)4-5-15(22)18(17)21)27-16-6-12(8-25-19(16)23)11-2-3-13(9-26)24-7-11/h2-5,12-16,30H,6-11H2,1H3,(H2,29,32);2-5,10-13,16,28H,6-9H2,1H3,(H2,27,30);2-5,10-13,28,31H,6-9H2,1H3,(H2,27,30);2*2-8,10,26H,9H2,1H3,(H2,23,25)
• InChIKey: HSQMGKAMDPVDFQ-UHFFFAOYSA-N
• XLogP: 26.01
• TPSA: 420.39 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 28
• Rotatable Bonds: 29
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2276.67
LogP ≤ 5	26.01
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine?

The IUPAC name of [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine (CID 158575845) is [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine.

What is the SMILES notation for [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine?

The canonical SMILES for [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine is CC(Oc1cc(-c2ccc(C3(O)CCNCC3)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(CO)cn2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(CO)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(OC3CCNCC3)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(-c2ccc(OCCC3CCNCC3)nc2)cnc1N)c1c(Cl)ccc(F)c1Cl.

What is the InChIKey of [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine?

The InChIKey is HSQMGKAMDPVDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27Cl2FN4O2.2C23H23Cl2FN4O2.2C19H16Cl2FN3O2/c1-15(23-19(26)3-4-20(28)24(23)27)34-21-12-18(14-32-25(21)29)17-2-5-22(31-13-17)33-11-8-16-6-9-30-10-7-16;1-13(21-17(24)3-4-18(26)22(21)25)31-19-10-15(12-30-23(19)27)14-2-5-20(29-11-14)32-16-6-8-28-9-7-16;1-13(20-16(24)3-4-17(26)21(20)25)32-18-10-15(12-30-22(18)27)14-2-5-19(29-11-14)23(31)6-8-28-9-7-23;1-10(17-13(20)3-4-14(22)18(17)21)27-16-6-12(8-25-19(16)23)15-5-2-11(9-26)7-24-15;1-10(17-14(20)4-5-15(22)18(17)21)27-16-6-12(8-25-19(16)23)11-2-3-13(9-26)24-7-11/h2-5,12-16,30H,6-11H2,1H3,(H2,29,32);2-5,10-13,16,28H,6-9H2,1H3,(H2,27,30);2-5,10-13,28,31H,6-9H2,1H3,(H2,27,30);2*2-8,10,26H,9H2,1H3,(H2,23,25).

What are the key properties of [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine?

[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine has a molecular weight of 2276.67 g/mol, XLogP of 26.01, 29 rotatable bonds, 11 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for [5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]methanol;[6-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-3-pyridinyl]methanol;4-[5-[6-amino-5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-pyridinyl]-2-pyridinyl]piperidin-4-ol;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[6-(2-piperidin-4-ylethoxy)-3-pyridinyl]pyridin-2-amine;3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(6-piperidin-4-yloxy-3-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 158575845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).