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

C21H17N3O — CID 10639924

IUPAC4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine
SMILESCOc1cccc(-c2nc(-c3ccccc3)[nH]c2-c2ccncc2)c1
InChIInChI=1S/C21H17N3O/c1-25-18-9-5-8-17(14-18)20-19(15-10-12-22-13-11-15)23-21(24-20)16-6-3-2-4-7-16/h2-14H,1H3,(H,23,24)
InChIKeyCYCXCKOESWCLST-UHFFFAOYSA-N
MW327.39 g/mol
LogP4.81
Rot. Bonds4

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

4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine (PubChem CID 10639924) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine.

Molecular Properties

Compound Name4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine
PubChem CID10639924
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC Name4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine
SMILESCOc1cccc(-c2nc(-c3ccccc3)[nH]c2-c2ccncc2)c1
InChIInChI=1S/C21H17N3O/c1-25-18-9-5-8-17(14-18)20-19(15-10-12-22-13-11-15)23-21(24-20)16-6-3-2-4-7-16/h2-14H,1H3,(H,23,24)
InChIKeyCYCXCKOESWCLST-UHFFFAOYSA-N
XLogP4.81
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine?
The IUPAC name of 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine (CID 10639924) is 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine.
What is the SMILES notation for 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine?
The canonical SMILES for 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine is COc1cccc(-c2nc(-c3ccccc3)[nH]c2-c2ccncc2)c1.
What is the InChIKey of 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine?
The InChIKey is CYCXCKOESWCLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O/c1-25-18-9-5-8-17(14-18)20-19(15-10-12-22-13-11-15)23-21(24-20)16-6-3-2-4-7-16/h2-14H,1H3,(H,23,24).
What are the key properties of 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine?
4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine has a molecular weight of 327.39 g/mol, XLogP of 4.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3-methoxyphenyl)-2-phenyl-1H-imidazol-5-yl]pyridine is sourced from PubChem (CID 10639924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).