2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine

C13H11N3O — CID 57329785

IUPAC2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine
SMILESc1cn(Cc2ccc(-c3ccoc3)nc2)cn1
InChIInChI=1S/C13H11N3O/c1-2-13(12-3-6-17-9-12)15-7-11(1)8-16-5-4-14-10-16/h1-7,9-10H,8H2
InChIKeyBDOFEVRLGSFGCU-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.59
Rot. Bonds3

About 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine

2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine (PubChem CID 57329785) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine.

Molecular Properties

Compound Name2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine
PubChem CID57329785
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine
SMILESc1cn(Cc2ccc(-c3ccoc3)nc2)cn1
InChIInChI=1S/C13H11N3O/c1-2-13(12-3-6-17-9-12)15-7-11(1)8-16-5-4-14-10-16/h1-7,9-10H,8H2
InChIKeyBDOFEVRLGSFGCU-UHFFFAOYSA-N
XLogP2.59
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine?
The IUPAC name of 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine (CID 57329785) is 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine.
What is the SMILES notation for 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine?
The canonical SMILES for 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine is c1cn(Cc2ccc(-c3ccoc3)nc2)cn1.
What is the InChIKey of 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine?
The InChIKey is BDOFEVRLGSFGCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-2-13(12-3-6-17-9-12)15-7-11(1)8-16-5-4-14-10-16/h1-7,9-10H,8H2.
What are the key properties of 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine?
2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine has a molecular weight of 225.25 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-5-(imidazol-1-ylmethyl)pyridine is sourced from PubChem (CID 57329785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).