2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole

C19H16N2O2 — CID 800777

IUPAC2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole
SMILESc1ccc(OCCn2c(-c3ccco3)nc3ccccc32)cc1
InChIInChI=1S/C19H16N2O2/c1-2-7-15(8-3-1)22-14-12-21-17-10-5-4-9-16(17)20-19(21)18-11-6-13-23-18/h1-11,13H,12,14H2
InChIKeyYFXYPPMYYWKFQS-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.38
Rot. Bonds5

About 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole

2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole (PubChem CID 800777) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole.

Molecular Properties

Compound Name2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole
PubChem CID800777
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole
SMILESc1ccc(OCCn2c(-c3ccco3)nc3ccccc32)cc1
InChIInChI=1S/C19H16N2O2/c1-2-7-15(8-3-1)22-14-12-21-17-10-5-4-9-16(17)20-19(21)18-11-6-13-23-18/h1-11,13H,12,14H2
InChIKeyYFXYPPMYYWKFQS-UHFFFAOYSA-N
XLogP4.38
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole?
The IUPAC name of 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole (CID 800777) is 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole.
What is the SMILES notation for 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole?
The canonical SMILES for 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole is c1ccc(OCCn2c(-c3ccco3)nc3ccccc32)cc1.
What is the InChIKey of 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole?
The InChIKey is YFXYPPMYYWKFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-2-7-15(8-3-1)22-14-12-21-17-10-5-4-9-16(17)20-19(21)18-11-6-13-23-18/h1-11,13H,12,14H2.
What are the key properties of 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole?
2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole has a molecular weight of 304.35 g/mol, XLogP of 4.38, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-(2-phenoxyethyl)benzimidazole is sourced from PubChem (CID 800777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).