2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine

C17H13FN6 — CID 141332373

IUPAC2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine
SMILESCn1nnc(-c2ccc(F)cc2)c1-c1cn(-c2ccccn2)cn1
InChIInChI=1S/C17H13FN6/c1-23-17(16(21-22-23)12-5-7-13(18)8-6-12)14-10-24(11-20-14)15-4-2-3-9-19-15/h2-11H,1H3
InChIKeyHIGJFNMLHHGDER-UHFFFAOYSA-N
MW320.33 g/mol
LogP2.87
Rot. Bonds3

About 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine

2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine (PubChem CID 141332373) has the molecular formula C17H13FN6 and a molecular weight of 320.33 g/mol. Its IUPAC name is 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine.

Molecular Properties

Compound Name2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine
PubChem CID141332373
Molecular FormulaC17H13FN6
Molecular Weight320.33 g/mol
Exact Mass320.12
IUPAC Name2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine
SMILESCn1nnc(-c2ccc(F)cc2)c1-c1cn(-c2ccccn2)cn1
InChIInChI=1S/C17H13FN6/c1-23-17(16(21-22-23)12-5-7-13(18)8-6-12)14-10-24(11-20-14)15-4-2-3-9-19-15/h2-11H,1H3
InChIKeyHIGJFNMLHHGDER-UHFFFAOYSA-N
XLogP2.87
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.33
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(4-fluorophenyl)-(1-pyridin-2-ylimidazol-4-yl)methanol
CID 177046880
2-[3-(4-fluorophenyl)pyrazol-1-yl]pyridine
CID 57213945
5-(4-fluorophenyl)-3-methyltriazol-4-amine
CID 83637005
4-(4-fluorophenyl)-1-methyl-5-propan-2-yltriazole
CID 176723263
2-[3-(4-fluorophenyl)-1-methylpyrazol-5-yl]-2-pyridin-2-ylethanamine
CID 83987390
4-[3-(4-fluorophenyl)-1-propan-2-ylpyrazol-4-yl]-2-(4-methylimidazol-1-yl)pyridine
CID 90465146
2-[4-bromo-5-(4-fluorophenyl)-3-propan-2-ylpyrazol-1-yl]pyridine
CID 14402917
6-[3-(4-fluorophenyl)-1-tritylpyrazol-4-yl]-1-pyridin-2-ylbenzimidazole
CID 22032169
4-[5-(4-fluorophenyl)-3-phenyltriazol-4-yl]-2-methylsulfanylpyrimidine
CID 59068560
2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine
CID 171056601
3-(5-fluoro-2-pyridinyl)-1-pyridin-2-ylpyrazol-4-amine
CID 83216889
3-(4-fluorophenyl)-1-pyrimidin-2-ylpyrazol-4-amine
CID 83222410

Frequently Asked Questions

What is the IUPAC name of 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine?
The IUPAC name of 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine (CID 141332373) is 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine.
What is the SMILES notation for 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine?
The canonical SMILES for 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine is Cn1nnc(-c2ccc(F)cc2)c1-c1cn(-c2ccccn2)cn1.
What is the InChIKey of 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine?
The InChIKey is HIGJFNMLHHGDER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN6/c1-23-17(16(21-22-23)12-5-7-13(18)8-6-12)14-10-24(11-20-14)15-4-2-3-9-19-15/h2-11H,1H3.
What are the key properties of 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine?
2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine has a molecular weight of 320.33 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[5-(4-fluorophenyl)-3-methyltriazol-4-yl]imidazol-1-yl]pyridine is sourced from PubChem (CID 141332373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).