3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine

C19H20F3N5 — CID 143944253

About 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine

3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine (PubChem CID 143944253) has the molecular formula C19H20F3N5 and a molecular weight of 375.40 g/mol. Its IUPAC name is 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
• PubChem CID: 143944253
• Molecular Formula: C19H20F3N5
• Molecular Weight: 375.40 g/mol
• Exact Mass: 375.17
• IUPAC Name: 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
• SMILES: Cc1[nH]cnc1CN1CCc2nc(-c3ccc(C(F)(F)F)cc3)n(C)c2C1
• InChI: InChI=1S/C19H20F3N5/c1-12-16(24-11-23-12)9-27-8-7-15-17(10-27)26(2)18(25-15)13-3-5-14(6-4-13)19(20,21)22/h3-6,11H,7-10H2,1-2H3,(H,23,24)
• InChIKey: NFABOYDPLGLLKB-UHFFFAOYSA-N
• XLogP: 3.70
• TPSA: 49.74 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	375.40
LogP ≤ 5	3.70
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

The IUPAC name of 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine (CID 143944253) is 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

What is the SMILES notation for 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

The canonical SMILES for 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine is Cc1[nH]cnc1CN1CCc2nc(-c3ccc(C(F)(F)F)cc3)n(C)c2C1.

What is the InChIKey of 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

The InChIKey is NFABOYDPLGLLKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3N5/c1-12-16(24-11-23-12)9-27-8-7-15-17(10-27)26(2)18(25-15)13-3-5-14(6-4-13)19(20,21)22/h3-6,11H,7-10H2,1-2H3,(H,23,24).

What are the key properties of 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine has a molecular weight of 375.40 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 143944253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).