5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine

C15H14N4O — CID 67516160

IUPAC5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine
SMILESCOc1ccc(-c2ccc(Cn3ccnc3)cn2)cn1
InChIInChI=1S/C15H14N4O/c1-20-15-5-3-13(9-18-15)14-4-2-12(8-17-14)10-19-7-6-16-11-19/h2-9,11H,10H2,1H3
InChIKeyXFIJVPQFPWCILT-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.40
Rot. Bonds4

About 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine

5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine (PubChem CID 67516160) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine.

Molecular Properties

Compound Name5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine
PubChem CID67516160
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine
SMILESCOc1ccc(-c2ccc(Cn3ccnc3)cn2)cn1
InChIInChI=1S/C15H14N4O/c1-20-15-5-3-13(9-18-15)14-4-2-12(8-17-14)10-19-7-6-16-11-19/h2-9,11H,10H2,1H3
InChIKeyXFIJVPQFPWCILT-UHFFFAOYSA-N
XLogP2.40
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine?
The IUPAC name of 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine (CID 67516160) is 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine.
What is the SMILES notation for 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine?
The canonical SMILES for 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine is COc1ccc(-c2ccc(Cn3ccnc3)cn2)cn1.
What is the InChIKey of 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine?
The InChIKey is XFIJVPQFPWCILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-20-15-5-3-13(9-18-15)14-4-2-12(8-17-14)10-19-7-6-16-11-19/h2-9,11H,10H2,1H3.
What are the key properties of 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine?
5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine has a molecular weight of 266.30 g/mol, XLogP of 2.40, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(imidazol-1-ylmethyl)-2-(6-methoxy-3-pyridinyl)pyridine is sourced from PubChem (CID 67516160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).