4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine

C20H17N3O — CID 167955879

IUPAC4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine
SMILESc1ccc2cc(OCCn3cnc(-c4ccncc4)c3)ccc2c1
InChIInChI=1S/C20H17N3O/c1-2-4-18-13-19(6-5-16(18)3-1)24-12-11-23-14-20(22-15-23)17-7-9-21-10-8-17/h1-10,13-15H,11-12H2
InChIKeyJHXYPYVRYPJGLH-UHFFFAOYSA-N
MW315.38 g/mol
LogP4.18
Rot. Bonds5

About 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine

4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine (PubChem CID 167955879) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine
PubChem CID167955879
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine
SMILESc1ccc2cc(OCCn3cnc(-c4ccncc4)c3)ccc2c1
InChIInChI=1S/C20H17N3O/c1-2-4-18-13-19(6-5-16(18)3-1)24-12-11-23-14-20(22-15-23)17-7-9-21-10-8-17/h1-10,13-15H,11-12H2
InChIKeyJHXYPYVRYPJGLH-UHFFFAOYSA-N
XLogP4.18
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine?
The IUPAC name of 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine (CID 167955879) is 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine.
What is the SMILES notation for 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine?
The canonical SMILES for 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine is c1ccc2cc(OCCn3cnc(-c4ccncc4)c3)ccc2c1.
What is the InChIKey of 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine?
The InChIKey is JHXYPYVRYPJGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c1-2-4-18-13-19(6-5-16(18)3-1)24-12-11-23-14-20(22-15-23)17-7-9-21-10-8-17/h1-10,13-15H,11-12H2.
What are the key properties of 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine?
4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine has a molecular weight of 315.38 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-naphthalen-2-yloxyethyl)imidazol-4-yl]pyridine is sourced from PubChem (CID 167955879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).