4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine

C20H20FN3 — CID 10567785

IUPAC4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
SMILESFc1ccc(-c2nc(C3CCCCC3)[nH]c2-c2ccncc2)cc1
InChIInChI=1S/C20H20FN3/c21-17-8-6-14(7-9-17)18-19(15-10-12-22-13-11-15)24-20(23-18)16-4-2-1-3-5-16/h6-13,16H,1-5H2,(H,23,24)
InChIKeyVPVLUCZRDCBSCN-UHFFFAOYSA-N
MW321.40 g/mol
LogP5.33
Rot. Bonds3

About 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine

4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine (PubChem CID 10567785) has the molecular formula C20H20FN3 and a molecular weight of 321.40 g/mol. Its IUPAC name is 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine.

Molecular Properties

Compound Name4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
PubChem CID10567785
Molecular FormulaC20H20FN3
Molecular Weight321.40 g/mol
Exact Mass321.16
IUPAC Name4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
SMILESFc1ccc(-c2nc(C3CCCCC3)[nH]c2-c2ccncc2)cc1
InChIInChI=1S/C20H20FN3/c21-17-8-6-14(7-9-17)18-19(15-10-12-22-13-11-15)24-20(23-18)16-4-2-1-3-5-16/h6-13,16H,1-5H2,(H,23,24)
InChIKeyVPVLUCZRDCBSCN-UHFFFAOYSA-N
XLogP5.33
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.40
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine?
The IUPAC name of 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine (CID 10567785) is 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine.
What is the SMILES notation for 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine?
The canonical SMILES for 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine is Fc1ccc(-c2nc(C3CCCCC3)[nH]c2-c2ccncc2)cc1.
What is the InChIKey of 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine?
The InChIKey is VPVLUCZRDCBSCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN3/c21-17-8-6-14(7-9-17)18-19(15-10-12-22-13-11-15)24-20(23-18)16-4-2-1-3-5-16/h6-13,16H,1-5H2,(H,23,24).
What are the key properties of 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine?
4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine has a molecular weight of 321.40 g/mol, XLogP of 5.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-cyclohexyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine is sourced from PubChem (CID 10567785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).