3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine

C15H10F3N3 — CID 10062681

IUPAC3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine
SMILESFC(F)(F)c1cccc(-c2cnc(-c3cccnc3)[nH]2)c1
InChIInChI=1S/C15H10F3N3/c16-15(17,18)12-5-1-3-10(7-12)13-9-20-14(21-13)11-4-2-6-19-8-11/h1-9H,(H,20,21)
InChIKeyRTNVHSKLMITTMV-UHFFFAOYSA-N
MW289.26 g/mol
LogP4.16
Rot. Bonds2

About 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine

3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine (PubChem CID 10062681) has the molecular formula C15H10F3N3 and a molecular weight of 289.26 g/mol. Its IUPAC name is 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine.

Molecular Properties

Compound Name3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine
PubChem CID10062681
Molecular FormulaC15H10F3N3
Molecular Weight289.26 g/mol
Exact Mass289.08
IUPAC Name3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine
SMILESFC(F)(F)c1cccc(-c2cnc(-c3cccnc3)[nH]2)c1
InChIInChI=1S/C15H10F3N3/c16-15(17,18)12-5-1-3-10(7-12)13-9-20-14(21-13)11-4-2-6-19-8-11/h1-9H,(H,20,21)
InChIKeyRTNVHSKLMITTMV-UHFFFAOYSA-N
XLogP4.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.26
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine?
The IUPAC name of 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine (CID 10062681) is 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine.
What is the SMILES notation for 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine?
The canonical SMILES for 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine is FC(F)(F)c1cccc(-c2cnc(-c3cccnc3)[nH]2)c1.
What is the InChIKey of 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine?
The InChIKey is RTNVHSKLMITTMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N3/c16-15(17,18)12-5-1-3-10(7-12)13-9-20-14(21-13)11-4-2-6-19-8-11/h1-9H,(H,20,21).
What are the key properties of 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine?
3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine has a molecular weight of 289.26 g/mol, XLogP of 4.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pyridine is sourced from PubChem (CID 10062681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).