2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole

Name: 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₀H₁₇FN₂O — CID 70992611

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole

SMILESCc1cc(CCc2c(F)cccc2-c2ncc[nH]2)c2occc2c1

InChIInChI=1S/C20H17FN2O/c1-13-11-14(19-15(12-13)7-10-24-19)5-6-16-17(3-2-4-18(16)21)20-22-8-9-23-20/h2-4,7-12H,5-6H2,1H3,(H,22,23)

InChIKeyUASJWNMTUGZMMN-UHFFFAOYSA-N

MW320.37 g/mol

LogP5.06

Rot. Bonds4

About 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole

2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole (PubChem CID 70992611) has the molecular formula C₂₀H₁₇FN₂O and a molecular weight of 320.37 g/mol. Its IUPAC name is 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole.

Molecular Properties

Compound Name	2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole
PubChem CID	70992611
Molecular Formula	C₂₀H₁₇FN₂O
Molecular Weight	320.37 g/mol
Exact Mass	320.13
IUPAC Name	2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole
SMILES	Cc1cc(CCc2c(F)cccc2-c2ncc[nH]2)c2occc2c1
InChI	InChI=1S/C20H17FN2O/c1-13-11-14(19-15(12-13)7-10-24-19)5-6-16-17(3-2-4-18(16)21)20-22-8-9-23-20/h2-4,7-12H,5-6H2,1H3,(H,22,23)
InChIKey	UASJWNMTUGZMMN-UHFFFAOYSA-N
XLogP	5.06
TPSA	41.82 Å²
H-Bond Donors	1
H-Bond Acceptors	2
Rotatable Bonds	4
Heavy Atoms	24
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	320.37
LogP ≤ 5	5.06
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole?

The IUPAC name of 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole (CID 70992611) is 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole.

What is the SMILES notation for 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole?

The canonical SMILES for 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole is Cc1cc(CCc2c(F)cccc2-c2ncc[nH]2)c2occc2c1.

What is the InChIKey of 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole?

The InChIKey is UASJWNMTUGZMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O/c1-13-11-14(19-15(12-13)7-10-24-19)5-6-16-17(3-2-4-18(16)21)20-22-8-9-23-20/h2-4,7-12H,5-6H2,1H3,(H,22,23).

What are the key properties of 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole?

2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole has a molecular weight of 320.37 g/mol, XLogP of 5.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-fluoro-2-[2-(5-methyl-1-benzofuran-7-yl)ethyl]phenyl]-1H-imidazole is sourced from PubChem (CID 70992611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 70992611 — identifiers, structure, computed properties (public domain)

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