2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline

C17H13F3N2O2 — CID 135271889

IUPAC2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline
SMILESCOc1ccc(-c2cc(C)cc3nc(OC(F)F)cnc23)cc1F
InChIInChI=1S/C17H13F3N2O2/c1-9-5-11(10-3-4-14(23-2)12(18)7-10)16-13(6-9)22-15(8-21-16)24-17(19)20/h3-8,17H,1-2H3
InChIKeyHGQXYWDWLPTMPN-UHFFFAOYSA-N
MW334.30 g/mol
LogP4.35
Rot. Bonds4

About 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline

2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline (PubChem CID 135271889) has the molecular formula C17H13F3N2O2 and a molecular weight of 334.30 g/mol. Its IUPAC name is 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline.

Molecular Properties

Compound Name2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline
PubChem CID135271889
Molecular FormulaC17H13F3N2O2
Molecular Weight334.30 g/mol
Exact Mass334.09
IUPAC Name2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline
SMILESCOc1ccc(-c2cc(C)cc3nc(OC(F)F)cnc23)cc1F
InChIInChI=1S/C17H13F3N2O2/c1-9-5-11(10-3-4-14(23-2)12(18)7-10)16-13(6-9)22-15(8-21-16)24-17(19)20/h3-8,17H,1-2H3
InChIKeyHGQXYWDWLPTMPN-UHFFFAOYSA-N
XLogP4.35
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.30
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(difluoromethoxy)-5-[4-fluoro-3-(trifluoromethyl)phenyl]-7-methylquinoxaline
CID 126509096
2-(difluoromethoxy)-5-(4,5-dimethoxy-1-benzofuran-2-yl)-7-methylquinoxaline
CID 134181058
5-(3-chloro-4-fluorophenyl)-2-methoxy-7-methylquinoxaline
CID 175844865
4-[2-(difluoromethoxy)-7-methylquinoxalin-5-yl]-2-(trifluoromethyl)benzaldehyde
CID 135275514
2-[2-(difluoromethoxy)-7-methylquinoxalin-5-yl]-4-methoxy-6-methyl-1,3-benzothiazole
CID 134180765
2-[2-(difluoromethoxy)-7-methylquinoxalin-5-yl]-5-pyridin-4-yl-1,3-thiazole
CID 134175452
2-[2-(difluoromethoxy)-7-methylquinoxalin-5-yl]-1,3-thiazole
CID 134175498
2-[2-[2-(difluoromethoxy)-7-methylquinoxalin-5-yl]-1,3-thiazol-5-yl]-4-methylphenol
CID 137300952
2-(difluoromethoxy)-5-imidazo[1,2-a]pyridin-2-yl-7-methylquinoxaline
CID 134180752
2-(difluoromethoxy)-5-(4-methoxyphenyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoxaline
CID 140891062
3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine
CID 157017577
(2R)-2-[[5-fluoro-2-(2-methoxy-7-methylquinoxalin-5-yl)-1,3-benzothiazol-6-yl]oxy]propan-1-ol
CID 134180418

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline?
The IUPAC name of 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline (CID 135271889) is 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline.
What is the SMILES notation for 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline?
The canonical SMILES for 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline is COc1ccc(-c2cc(C)cc3nc(OC(F)F)cnc23)cc1F.
What is the InChIKey of 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline?
The InChIKey is HGQXYWDWLPTMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F3N2O2/c1-9-5-11(10-3-4-14(23-2)12(18)7-10)16-13(6-9)22-15(8-21-16)24-17(19)20/h3-8,17H,1-2H3.
What are the key properties of 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline?
2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline has a molecular weight of 334.30 g/mol, XLogP of 4.35, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-5-(3-fluoro-4-methoxyphenyl)-7-methylquinoxaline is sourced from PubChem (CID 135271889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).