2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline

C20H15F3N4O — CID 165415143

IUPAC2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline
SMILESCn1cc(-c2ccccc2)nc1COc1nc2ccccc2nc1C(F)(F)F
InChIInChI=1S/C20H15F3N4O/c1-27-11-16(13-7-3-2-4-8-13)24-17(27)12-28-19-18(20(21,22)23)25-14-9-5-6-10-15(14)26-19/h2-11H,12H2,1H3
InChIKeySNMWMOQANVUBCY-UHFFFAOYSA-N
MW384.36 g/mol
LogP4.63
Rot. Bonds4

About 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline

2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline (PubChem CID 165415143) has the molecular formula C20H15F3N4O and a molecular weight of 384.36 g/mol. Its IUPAC name is 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline.

Molecular Properties

Compound Name2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline
PubChem CID165415143
Molecular FormulaC20H15F3N4O
Molecular Weight384.36 g/mol
Exact Mass384.12
IUPAC Name2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline
SMILESCn1cc(-c2ccccc2)nc1COc1nc2ccccc2nc1C(F)(F)F
InChIInChI=1S/C20H15F3N4O/c1-27-11-16(13-7-3-2-4-8-13)24-17(27)12-28-19-18(20(21,22)23)25-14-9-5-6-10-15(14)26-19/h2-11H,12H2,1H3
InChIKeySNMWMOQANVUBCY-UHFFFAOYSA-N
XLogP4.63
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.36
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-Phenylethynyl)-2-(2-pyrrolidin-1-ylethoxy)pyrido[2,3-b]pyrazine
CID 56682080
2-Methyl-3-[2-[4-phenyl-1-(2,2,2-trifluoroethyl)imidazol-2-yl]ethyl]quinoxaline
CID 165414867
2-[(1-Methyl-4-phenylimidazol-2-yl)methoxy]-3-pyrrolidin-1-ylquinoxaline
CID 165415018
3-Chloro-6-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
CID 165415055
2-Chloro-6-methyl-3-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
CID 165415084
6-Chloro-3-methyl-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
CID 165415106
6-Chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
CID 165415115
6-Chloro-2-methyl-3-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinoxaline
CID 165415208
2-[[4-(4-Chlorophenyl)-1-methylimidazol-2-yl]methoxy]-3-methylquinoxaline
CID 165415228
5-(4-Fluorophenyl)-3-[1-(2-methoxyethyl)benzimidazol-2-yl]pyrazin-2-amine
CID 44532967
2-[3-[2-(3-fluorophenyl)ethynyl]pyrido[2,3-b]pyrazin-2-yl]oxy-N,N-dimethylethanamine
CID 53494904
2-(1-Methylpiperidin-3-yl)oxy-3-(2-phenylethynyl)pyrido[2,3-b]pyrazine
CID 56675422

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline?
The IUPAC name of 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline (CID 165415143) is 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline.
What is the SMILES notation for 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline?
The canonical SMILES for 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline is Cn1cc(-c2ccccc2)nc1COc1nc2ccccc2nc1C(F)(F)F.
What is the InChIKey of 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline?
The InChIKey is SNMWMOQANVUBCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F3N4O/c1-27-11-16(13-7-3-2-4-8-13)24-17(27)12-28-19-18(20(21,22)23)25-14-9-5-6-10-15(14)26-19/h2-11H,12H2,1H3.
What are the key properties of 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline?
2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline has a molecular weight of 384.36 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-3-(trifluoromethyl)quinoxaline is sourced from PubChem (CID 165415143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).