4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine

C10H8F3N3 — CID 22759809

IUPAC4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine
SMILESCn1c(C(F)(F)F)cnc1-c1ccncc1
InChIInChI=1S/C10H8F3N3/c1-16-8(10(11,12)13)6-15-9(16)7-2-4-14-5-3-7/h2-6H,1H3
InChIKeyMWWYCYLQXQLOOV-UHFFFAOYSA-N
MW227.19 g/mol
LogP2.50
Rot. Bonds1

About 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine

4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine (PubChem CID 22759809) has the molecular formula C10H8F3N3 and a molecular weight of 227.19 g/mol. Its IUPAC name is 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine.

Molecular Properties

Compound Name4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine
PubChem CID22759809
Molecular FormulaC10H8F3N3
Molecular Weight227.19 g/mol
Exact Mass227.07
IUPAC Name4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine
SMILESCn1c(C(F)(F)F)cnc1-c1ccncc1
InChIInChI=1S/C10H8F3N3/c1-16-8(10(11,12)13)6-15-9(16)7-2-4-14-5-3-7/h2-6H,1H3
InChIKeyMWWYCYLQXQLOOV-UHFFFAOYSA-N
XLogP2.50
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.19
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine?
The IUPAC name of 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine (CID 22759809) is 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine.
What is the SMILES notation for 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine?
The canonical SMILES for 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine is Cn1c(C(F)(F)F)cnc1-c1ccncc1.
What is the InChIKey of 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine?
The InChIKey is MWWYCYLQXQLOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N3/c1-16-8(10(11,12)13)6-15-9(16)7-2-4-14-5-3-7/h2-6H,1H3.
What are the key properties of 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine?
4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine has a molecular weight of 227.19 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-methyl-5-(trifluoromethyl)imidazol-2-yl]pyridine is sourced from PubChem (CID 22759809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).