2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine

C20H17F3N4 — CID 10155997

About 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine

2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine (PubChem CID 10155997) has the molecular formula C20H17F3N4 and a molecular weight of 370.38 g/mol. Its IUPAC name is 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine.

Molecular Properties

• Compound Name: 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine
• PubChem CID: 10155997
• Molecular Formula: C20H17F3N4
• Molecular Weight: 370.38 g/mol
• Exact Mass: 370.14
• IUPAC Name: 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine
• SMILES: FC(F)(F)c1cccc(-c2cnc(C3=CCN(c4ccccn4)CC3)[nH]2)c1
• InChI: InChI=1S/C20H17F3N4/c21-20(22,23)16-5-3-4-15(12-16)17-13-25-19(26-17)14-7-10-27(11-8-14)18-6-1-2-9-24-18/h1-7,9,12-13H,8,10-11H2,(H,25,26)
• InChIKey: PKMLPWVYCIQXEU-UHFFFAOYSA-N
• XLogP: 4.78
• TPSA: 44.81 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	370.38
LogP ≤ 5	4.78
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

The IUPAC name of 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine (CID 10155997) is 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine.

What is the SMILES notation for 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

The canonical SMILES for 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine is FC(F)(F)c1cccc(-c2cnc(C3=CCN(c4ccccn4)CC3)[nH]2)c1.

What is the InChIKey of 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

The InChIKey is PKMLPWVYCIQXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F3N4/c21-20(22,23)16-5-3-4-15(12-16)17-13-25-19(26-17)14-7-10-27(11-8-14)18-6-1-2-9-24-18/h1-7,9,12-13H,8,10-11H2,(H,25,26).

What are the key properties of 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine?

2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine has a molecular weight of 370.38 g/mol, XLogP of 4.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-3,6-dihydro-2H-pyridin-1-yl]pyridine is sourced from PubChem (CID 10155997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).