4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine

C17H14FN3 — CID 10468825

IUPAC4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine
SMILESFc1ccc(-c2ncn(C3CC3)c2-c2ccncc2)cc1
InChIInChI=1S/C17H14FN3/c18-14-3-1-12(2-4-14)16-17(13-7-9-19-10-8-13)21(11-20-16)15-5-6-15/h1-4,7-11,15H,5-6H2
InChIKeyVXSHGJJXHHEQII-UHFFFAOYSA-N
MW279.32 g/mol
LogP4.09
Rot. Bonds3

About 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine

4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine (PubChem CID 10468825) has the molecular formula C17H14FN3 and a molecular weight of 279.32 g/mol. Its IUPAC name is 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine
PubChem CID10468825
Molecular FormulaC17H14FN3
Molecular Weight279.32 g/mol
Exact Mass279.12
IUPAC Name4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine
SMILESFc1ccc(-c2ncn(C3CC3)c2-c2ccncc2)cc1
InChIInChI=1S/C17H14FN3/c18-14-3-1-12(2-4-14)16-17(13-7-9-19-10-8-13)21(11-20-16)15-5-6-15/h1-4,7-11,15H,5-6H2
InChIKeyVXSHGJJXHHEQII-UHFFFAOYSA-N
XLogP4.09
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine?
The IUPAC name of 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine (CID 10468825) is 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine.
What is the SMILES notation for 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine?
The canonical SMILES for 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine is Fc1ccc(-c2ncn(C3CC3)c2-c2ccncc2)cc1.
What is the InChIKey of 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine?
The InChIKey is VXSHGJJXHHEQII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3/c18-14-3-1-12(2-4-14)16-17(13-7-9-19-10-8-13)21(11-20-16)15-5-6-15/h1-4,7-11,15H,5-6H2.
What are the key properties of 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine?
4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine has a molecular weight of 279.32 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-cyclopropyl-5-(4-fluorophenyl)imidazol-4-yl]pyridine is sourced from PubChem (CID 10468825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).