5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine

C21H17N3 — CID 67515869

IUPAC5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine
SMILESc1ccc(-c2cc(Cn3ccnc3)cnc2-c2ccccc2)cc1
InChIInChI=1S/C21H17N3/c1-3-7-18(8-4-1)20-13-17(15-24-12-11-22-16-24)14-23-21(20)19-9-5-2-6-10-19/h1-14,16H,15H2
InChIKeyVOUNNULXUYBOJJ-UHFFFAOYSA-N
MW311.39 g/mol
LogP4.66
Rot. Bonds4

About 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine

5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine (PubChem CID 67515869) has the molecular formula C21H17N3 and a molecular weight of 311.39 g/mol. Its IUPAC name is 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine.

Molecular Properties

Compound Name5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine
PubChem CID67515869
Molecular FormulaC21H17N3
Molecular Weight311.39 g/mol
Exact Mass311.14
IUPAC Name5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine
SMILESc1ccc(-c2cc(Cn3ccnc3)cnc2-c2ccccc2)cc1
InChIInChI=1S/C21H17N3/c1-3-7-18(8-4-1)20-13-17(15-24-12-11-22-16-24)14-23-21(20)19-9-5-2-6-10-19/h1-14,16H,15H2
InChIKeyVOUNNULXUYBOJJ-UHFFFAOYSA-N
XLogP4.66
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine?
The IUPAC name of 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine (CID 67515869) is 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine.
What is the SMILES notation for 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine?
The canonical SMILES for 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine is c1ccc(-c2cc(Cn3ccnc3)cnc2-c2ccccc2)cc1.
What is the InChIKey of 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine?
The InChIKey is VOUNNULXUYBOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3/c1-3-7-18(8-4-1)20-13-17(15-24-12-11-22-16-24)14-23-21(20)19-9-5-2-6-10-19/h1-14,16H,15H2.
What are the key properties of 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine?
5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine has a molecular weight of 311.39 g/mol, XLogP of 4.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(imidazol-1-ylmethyl)-2,3-diphenylpyridine is sourced from PubChem (CID 67515869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).