5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine

C23H17N3 — CID 10427080

IUPAC5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine
SMILESc1ccc(-c2nc3ccn(Cc4cccc5ccccc45)cc-3n2)cc1
InChIInChI=1S/C23H17N3/c1-2-8-18(9-3-1)23-24-21-13-14-26(16-22(21)25-23)15-19-11-6-10-17-7-4-5-12-20(17)19/h1-14,16H,15H2
InChIKeyXOJOAELDPAJCPP-UHFFFAOYSA-N
MW335.41 g/mol
LogP5.25
Rot. Bonds3

About 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine

5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine (PubChem CID 10427080) has the molecular formula C23H17N3 and a molecular weight of 335.41 g/mol. Its IUPAC name is 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine
PubChem CID10427080
Molecular FormulaC23H17N3
Molecular Weight335.41 g/mol
Exact Mass335.14
IUPAC Name5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine
SMILESc1ccc(-c2nc3ccn(Cc4cccc5ccccc45)cc-3n2)cc1
InChIInChI=1S/C23H17N3/c1-2-8-18(9-3-1)23-24-21-13-14-26(16-22(21)25-23)15-19-11-6-10-17-7-4-5-12-20(17)19/h1-14,16H,15H2
InChIKeyXOJOAELDPAJCPP-UHFFFAOYSA-N
XLogP5.25
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.41
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine?
The IUPAC name of 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine (CID 10427080) is 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine?
The canonical SMILES for 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine is c1ccc(-c2nc3ccn(Cc4cccc5ccccc45)cc-3n2)cc1.
What is the InChIKey of 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine?
The InChIKey is XOJOAELDPAJCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3/c1-2-8-18(9-3-1)23-24-21-13-14-26(16-22(21)25-23)15-19-11-6-10-17-7-4-5-12-20(17)19/h1-14,16H,15H2.
What are the key properties of 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine?
5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine has a molecular weight of 335.41 g/mol, XLogP of 5.25, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(naphthalen-1-ylmethyl)-2-phenylimidazo[4,5-c]pyridine is sourced from PubChem (CID 10427080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).