2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole

C17H17FN2O2S — CID 56866785

IUPAC2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole
SMILESCOc1ccc(F)cc1-c1nccn1CC(OC)c1cccs1
InChIInChI=1S/C17H17FN2O2S/c1-21-14-6-5-12(18)10-13(14)17-19-7-8-20(17)11-15(22-2)16-4-3-9-23-16/h3-10,15H,11H2,1-2H3
InChIKeyRMJRBBFEDPKOPT-UHFFFAOYSA-N
MW332.40 g/mol
LogP4.15
Rot. Bonds6

About 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole

2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole (PubChem CID 56866785) has the molecular formula C17H17FN2O2S and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole.

Molecular Properties

Compound Name2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole
PubChem CID56866785
Molecular FormulaC17H17FN2O2S
Molecular Weight332.40 g/mol
Exact Mass332.10
IUPAC Name2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole
SMILESCOc1ccc(F)cc1-c1nccn1CC(OC)c1cccs1
InChIInChI=1S/C17H17FN2O2S/c1-21-14-6-5-12(18)10-13(14)17-19-7-8-20(17)11-15(22-2)16-4-3-9-23-16/h3-10,15H,11H2,1-2H3
InChIKeyRMJRBBFEDPKOPT-UHFFFAOYSA-N
XLogP4.15
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(4-methoxyphenyl)methyl]-4-(thiophen-3-yl)-1H-imidazole
CID 6539903
N-(1-methylimidazol-2-yl)-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67516491
1-[1-[2-(3-Thienylmethoxy)phenyl]vinyl]imidazole
CID 3007521
1-[1-[2-[(2-Chloro-3-thienyl)methoxy]phenyl]vinyl]imidazole
CID 3007522
N-[(2-fluoro-5-methoxyphenyl)methyl]-3-imidazol-1-yl-N-[(5-methylthiophen-2-yl)methyl]propan-1-amine
CID 16676802
1-[[4-(4-Methoxyphenyl)thiophen-2-yl]methyl]imidazole
CID 44456417
1-[[4-(3-Methoxyphenyl)thiophen-2-yl]methyl]imidazole
CID 44456419
1-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-N-(thiophen-2-ylmethyl)ethanamine
CID 75382433
1-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-N-(thiophen-3-ylmethyl)ethanamine
CID 75382753
4-(4-fluorophenyl)-4-(imidazol-1-ylmethyl)-2-[5-(4-methoxyphenyl)thiophen-2-yl]-5H-1,3-oxazole
CID 168270005
4-(4-fluorophenyl)-4-(imidazol-1-ylmethyl)-2-[5-[4-(2,2,2-trifluoroethoxy)phenyl]thiophen-2-yl]-5H-1,3-oxazole
CID 168270968
4-(4-fluorophenyl)-4-(imidazol-1-ylmethyl)-2-[5-[3-(trifluoromethoxy)phenyl]thiophen-2-yl]-5H-1,3-oxazole
CID 168289704

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole?
The IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole (CID 56866785) is 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole.
What is the SMILES notation for 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole?
The canonical SMILES for 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole is COc1ccc(F)cc1-c1nccn1CC(OC)c1cccs1.
What is the InChIKey of 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole?
The InChIKey is RMJRBBFEDPKOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2S/c1-21-14-6-5-12(18)10-13(14)17-19-7-8-20(17)11-15(22-2)16-4-3-9-23-16/h3-10,15H,11H2,1-2H3.
What are the key properties of 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole?
2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole has a molecular weight of 332.40 g/mol, XLogP of 4.15, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methoxyphenyl)-1-(2-methoxy-2-thiophen-2-ylethyl)imidazole is sourced from PubChem (CID 56866785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).