4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine

C20H14ClN3 — CID 10664281

IUPAC4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine
SMILESClc1ccccc1-c1[nH]c(-c2ccccc2)nc1-c1ccncc1
InChIInChI=1S/C20H14ClN3/c21-17-9-5-4-8-16(17)19-18(14-10-12-22-13-11-14)23-20(24-19)15-6-2-1-3-7-15/h1-13H,(H,23,24)
InChIKeyQUZUYBVTTGUAGJ-UHFFFAOYSA-N
MW331.81 g/mol
LogP5.46
Rot. Bonds3

About 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine

4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine (PubChem CID 10664281) has the molecular formula C20H14ClN3 and a molecular weight of 331.81 g/mol. Its IUPAC name is 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine
PubChem CID10664281
Molecular FormulaC20H14ClN3
Molecular Weight331.81 g/mol
Exact Mass331.09
IUPAC Name4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine
SMILESClc1ccccc1-c1[nH]c(-c2ccccc2)nc1-c1ccncc1
InChIInChI=1S/C20H14ClN3/c21-17-9-5-4-8-16(17)19-18(14-10-12-22-13-11-14)23-20(24-19)15-6-2-1-3-7-15/h1-13H,(H,23,24)
InChIKeyQUZUYBVTTGUAGJ-UHFFFAOYSA-N
XLogP5.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.81
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine?
The IUPAC name of 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine (CID 10664281) is 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine.
What is the SMILES notation for 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine?
The canonical SMILES for 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine is Clc1ccccc1-c1[nH]c(-c2ccccc2)nc1-c1ccncc1.
What is the InChIKey of 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine?
The InChIKey is QUZUYBVTTGUAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClN3/c21-17-9-5-4-8-16(17)19-18(14-10-12-22-13-11-14)23-20(24-19)15-6-2-1-3-7-15/h1-13H,(H,23,24).
What are the key properties of 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine?
4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine has a molecular weight of 331.81 g/mol, XLogP of 5.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(2-chlorophenyl)-2-phenyl-1H-imidazol-4-yl]pyridine is sourced from PubChem (CID 10664281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).