ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)

C106H146F2N24O2 — CID 159778620

About ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)

ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine) (PubChem CID 159778620) has the molecular formula C106H146F2N24O2 and a molecular weight of 1826.50 g/mol. Its IUPAC name is ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine).

Molecular Properties

• Compound Name: ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)
• PubChem CID: 159778620
• Molecular Formula: C106H146F2N24O2
• Molecular Weight: 1826.50 g/mol
• Exact Mass: 1825.20
• IUPAC Name: ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)
• SMILES: CC.CC.CC.CC.CC(C)c1cnc(-n2ccnc2)c(F)c1.COc1cc(C(C)C)cnc1-n1ccnc1.COc1cc(C(C)C)cnc1-n1cnc(C)c1.Cc1cc(C(C)C)cnc1-n1ccnc1.Cc1cc(C(C)C)cnc1-n1ccnc1.Cc1cn(-c2ncc(C(C)C)cc2C)cn1.Cc1cn(-c2ncc(C(C)C)cc2C)cn1.Cc1cn(-c2ncc(C(C)C)cc2F)cn1
• InChI: InChI=1S/C13H17N3O.2C13H17N3.C12H14FN3.C12H15N3O.2C12H15N3.C11H12FN3.4C2H6/c1-9(2)11-5-12(17-4)13(14-6-11)16-7-10(3)15-8-16;2*1-9(2)12-5-10(3)13(14-6-12)16-7-11(4)15-8-16;1-8(2)10-4-11(13)12(14-5-10)16-6-9(3)15-7-16;1-9(2)10-6-11(16-3)12(14-7-10)15-5-4-13-8-15;2*1-9(2)11-6-10(3)12(14-7-11)15-5-4-13-8-15;1-8(2)9-5-10(12)11(14-6-9)15-4-3-13-7-15;4*1-2/h5-9H,1-4H3;2*5-9H,1-4H3;4-8H,1-3H3;4-9H,1-3H3;2*4-9H,1-3H3;3-8H,1-2H3;4*1-2H3
• InChIKey: NHBKOEJRHBDZDV-UHFFFAOYSA-N
• XLogP: 25.99
• TPSA: 264.14 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 18
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1826.50
LogP ≤ 5	25.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)?

The IUPAC name of ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine) (CID 159778620) is ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine).

What is the SMILES notation for ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)?

The canonical SMILES for ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine) is CC.CC.CC.CC.CC(C)c1cnc(-n2ccnc2)c(F)c1.COc1cc(C(C)C)cnc1-n1ccnc1.COc1cc(C(C)C)cnc1-n1cnc(C)c1.Cc1cc(C(C)C)cnc1-n1ccnc1.Cc1cc(C(C)C)cnc1-n1ccnc1.Cc1cn(-c2ncc(C(C)C)cc2C)cn1.Cc1cn(-c2ncc(C(C)C)cc2C)cn1.Cc1cn(-c2ncc(C(C)C)cc2F)cn1.

What is the InChIKey of ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)?

The InChIKey is NHBKOEJRHBDZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O.2C13H17N3.C12H14FN3.C12H15N3O.2C12H15N3.C11H12FN3.4C2H6/c1-9(2)11-5-12(17-4)13(14-6-11)16-7-10(3)15-8-16;2*1-9(2)12-5-10(3)13(14-6-12)16-7-11(4)15-8-16;1-8(2)10-4-11(13)12(14-5-10)16-6-9(3)15-7-16;1-9(2)10-6-11(16-3)12(14-7-10)15-5-4-13-8-15;2*1-9(2)11-6-10(3)12(14-7-11)15-5-4-13-8-15;1-8(2)9-5-10(12)11(14-6-9)15-4-3-13-7-15;4*1-2/h5-9H,1-4H3;2*5-9H,1-4H3;4-8H,1-3H3;4-9H,1-3H3;2*4-9H,1-3H3;3-8H,1-2H3;4*1-2H3.

What are the key properties of ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine)?

ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine) has a molecular weight of 1826.50 g/mol, XLogP of 25.99, 18 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;3-fluoro-2-imidazol-1-yl-5-propan-2-ylpyridine;3-fluoro-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;2-imidazol-1-yl-3-methoxy-5-propan-2-ylpyridine;bis(2-imidazol-1-yl-3-methyl-5-propan-2-ylpyridine);3-methoxy-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine;bis(3-methyl-2-(4-methylimidazol-1-yl)-5-propan-2-ylpyridine) is sourced from PubChem (CID 159778620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).