furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone

C21H16N2O3 — CID 67430389

IUPACfuran-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone
SMILESCOc1ccccc1-c1cccc(-n2cnc(C(=O)c3ccco3)c2)c1
InChIInChI=1S/C21H16N2O3/c1-25-19-9-3-2-8-17(19)15-6-4-7-16(12-15)23-13-18(22-14-23)21(24)20-10-5-11-26-20/h2-14H,1H3
InChIKeyHKFCPWFIWNEPGO-UHFFFAOYSA-N
MW344.37 g/mol
LogP4.37
Rot. Bonds5

About furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone

furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone (PubChem CID 67430389) has the molecular formula C21H16N2O3 and a molecular weight of 344.37 g/mol. Its IUPAC name is furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone
PubChem CID67430389
Molecular FormulaC21H16N2O3
Molecular Weight344.37 g/mol
Exact Mass344.12
IUPAC Namefuran-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone
SMILESCOc1ccccc1-c1cccc(-n2cnc(C(=O)c3ccco3)c2)c1
InChIInChI=1S/C21H16N2O3/c1-25-19-9-3-2-8-17(19)15-6-4-7-16(12-15)23-13-18(22-14-23)21(24)20-10-5-11-26-20/h2-14H,1H3
InChIKeyHKFCPWFIWNEPGO-UHFFFAOYSA-N
XLogP4.37
TPSA57.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone?
The IUPAC name of furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone (CID 67430389) is furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone.
What is the SMILES notation for furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone?
The canonical SMILES for furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone is COc1ccccc1-c1cccc(-n2cnc(C(=O)c3ccco3)c2)c1.
What is the InChIKey of furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone?
The InChIKey is HKFCPWFIWNEPGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O3/c1-25-19-9-3-2-8-17(19)15-6-4-7-16(12-15)23-13-18(22-14-23)21(24)20-10-5-11-26-20/h2-14H,1H3.
What are the key properties of furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone?
furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone has a molecular weight of 344.37 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[1-[3-(2-methoxyphenyl)phenyl]imidazol-4-yl]methanone is sourced from PubChem (CID 67430389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).