3-imidazol-1-yl-4-(trifluoromethyl)pyridine

C9H6F3N3 — CID 141130446

IUPAC3-imidazol-1-yl-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccncc1-n1ccnc1
InChIInChI=1S/C9H6F3N3/c10-9(11,12)7-1-2-13-5-8(7)15-4-3-14-6-15/h1-6H
InChIKeyVSKVPOOMQNZQNF-UHFFFAOYSA-N
MW213.16 g/mol
LogP2.29
Rot. Bonds1

About 3-imidazol-1-yl-4-(trifluoromethyl)pyridine

3-imidazol-1-yl-4-(trifluoromethyl)pyridine (PubChem CID 141130446) has the molecular formula C9H6F3N3 and a molecular weight of 213.16 g/mol. Its IUPAC name is 3-imidazol-1-yl-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-imidazol-1-yl-4-(trifluoromethyl)pyridine
PubChem CID141130446
Molecular FormulaC9H6F3N3
Molecular Weight213.16 g/mol
Exact Mass213.05
IUPAC Name3-imidazol-1-yl-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccncc1-n1ccnc1
InChIInChI=1S/C9H6F3N3/c10-9(11,12)7-1-2-13-5-8(7)15-4-3-14-6-15/h1-6H
InChIKeyVSKVPOOMQNZQNF-UHFFFAOYSA-N
XLogP2.29
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.16
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-imidazol-1-yl-4-(trifluoromethyl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-3-imidazol-1-ylpyridine
CID 84688960
[4-imidazol-1-yl-3-(trifluoromethyl)phenyl]methanamine
CID 66633522
4-(trifluoromethyl)pyridin-3-ol
CID 25210497
5,8-di(imidazol-1-yl)quinoxaline
CID 132507181
1-[2,3-di(imidazol-1-yl)phenyl]imidazole
CID 141435532
4-fluoro-3-hydroxy-N-[4-imidazol-1-yl-3-(trifluoromethyl)phenyl]benzamide
CID 20597281
1-[2-(trifluoromethylsulfonyl)phenyl]imidazole
CID 52855383
3-[(3S)-3-methylpiperidin-1-yl]-4-(trifluoromethyl)pyridine
CID 175211299
2-imidazol-1-yl-5-(trifluoromethyl)benzenecarbothioamide
CID 43331299
5-amino-1-[4-(trifluoromethyl)-3-pyridinyl]pyrazole-4-carbonitrile
CID 58110903
2-imidazol-1-yl-6-(trifluoromethyl)pyridine
CID 53217359
5-oxo-1-[4-(trifluoromethyl)-3-pyridinyl]pyrrolidine-3-carboxamide
CID 168698147

Frequently Asked Questions

What is the IUPAC name of 3-imidazol-1-yl-4-(trifluoromethyl)pyridine?
The IUPAC name of 3-imidazol-1-yl-4-(trifluoromethyl)pyridine (CID 141130446) is 3-imidazol-1-yl-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-imidazol-1-yl-4-(trifluoromethyl)pyridine?
The canonical SMILES for 3-imidazol-1-yl-4-(trifluoromethyl)pyridine is FC(F)(F)c1ccncc1-n1ccnc1.
What is the InChIKey of 3-imidazol-1-yl-4-(trifluoromethyl)pyridine?
The InChIKey is VSKVPOOMQNZQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F3N3/c10-9(11,12)7-1-2-13-5-8(7)15-4-3-14-6-15/h1-6H.
What are the key properties of 3-imidazol-1-yl-4-(trifluoromethyl)pyridine?
3-imidazol-1-yl-4-(trifluoromethyl)pyridine has a molecular weight of 213.16 g/mol, XLogP of 2.29, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazol-1-yl-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 141130446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).