2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine

C20H13Cl2N3 — CID 150454415

IUPAC2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine
SMILESClc1cc(Cl)cc(-c2nc(-c3ccccn3)[nH]c2-c2ccccc2)c1
InChIInChI=1S/C20H13Cl2N3/c21-15-10-14(11-16(22)12-15)19-18(13-6-2-1-3-7-13)24-20(25-19)17-8-4-5-9-23-17/h1-12H,(H,24,25)
InChIKeyHOLZFZRGEJUUHW-UHFFFAOYSA-N
MW366.25 g/mol
LogP6.11
Rot. Bonds3

About 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine

2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine (PubChem CID 150454415) has the molecular formula C20H13Cl2N3 and a molecular weight of 366.25 g/mol. Its IUPAC name is 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine.

Molecular Properties

Compound Name2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine
PubChem CID150454415
Molecular FormulaC20H13Cl2N3
Molecular Weight366.25 g/mol
Exact Mass365.05
IUPAC Name2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine
SMILESClc1cc(Cl)cc(-c2nc(-c3ccccn3)[nH]c2-c2ccccc2)c1
InChIInChI=1S/C20H13Cl2N3/c21-15-10-14(11-16(22)12-15)19-18(13-6-2-1-3-7-13)24-20(25-19)17-8-4-5-9-23-17/h1-12H,(H,24,25)
InChIKeyHOLZFZRGEJUUHW-UHFFFAOYSA-N
XLogP6.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.25
LogP ≤ 56.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imidazole_A(19)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine?
The IUPAC name of 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine (CID 150454415) is 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine.
What is the SMILES notation for 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine?
The canonical SMILES for 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine is Clc1cc(Cl)cc(-c2nc(-c3ccccn3)[nH]c2-c2ccccc2)c1.
What is the InChIKey of 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine?
The InChIKey is HOLZFZRGEJUUHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13Cl2N3/c21-15-10-14(11-16(22)12-15)19-18(13-6-2-1-3-7-13)24-20(25-19)17-8-4-5-9-23-17/h1-12H,(H,24,25).
What are the key properties of 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine?
2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine has a molecular weight of 366.25 g/mol, XLogP of 6.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3,5-dichlorophenyl)-5-phenyl-1H-imidazol-2-yl]pyridine is sourced from PubChem (CID 150454415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).