2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine

C18H19N3O — CID 71548383

IUPAC2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine
SMILESCCC(c1ccc(-c2ccccc2OC)cn1)n1ccnc1
InChIInChI=1S/C18H19N3O/c1-3-17(21-11-10-19-13-21)16-9-8-14(12-20-16)15-6-4-5-7-18(15)22-2/h4-13,17H,3H2,1-2H3
InChIKeyJGDJJBVYOTZOSZ-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.95
Rot. Bonds5

About 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine

2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine (PubChem CID 71548383) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine.

Molecular Properties

Compound Name2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine
PubChem CID71548383
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine
SMILESCCC(c1ccc(-c2ccccc2OC)cn1)n1ccnc1
InChIInChI=1S/C18H19N3O/c1-3-17(21-11-10-19-13-21)16-9-8-14(12-20-16)15-6-4-5-7-18(15)22-2/h4-13,17H,3H2,1-2H3
InChIKeyJGDJJBVYOTZOSZ-UHFFFAOYSA-N
XLogP3.95
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine?
The IUPAC name of 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine (CID 71548383) is 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine.
What is the SMILES notation for 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine?
The canonical SMILES for 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine is CCC(c1ccc(-c2ccccc2OC)cn1)n1ccnc1.
What is the InChIKey of 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine?
The InChIKey is JGDJJBVYOTZOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-3-17(21-11-10-19-13-21)16-9-8-14(12-20-16)15-6-4-5-7-18(15)22-2/h4-13,17H,3H2,1-2H3.
What are the key properties of 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine?
2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine has a molecular weight of 293.37 g/mol, XLogP of 3.95, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine is sourced from PubChem (CID 71548383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).