2-[(3-fluorophenyl)methoxy]-3-methylpyrazine

C12H11FN2O — CID 126954248

IUPAC2-[(3-fluorophenyl)methoxy]-3-methylpyrazine
SMILESCc1nccnc1OCc1cccc(F)c1
InChIInChI=1S/C12H11FN2O/c1-9-12(15-6-5-14-9)16-8-10-3-2-4-11(13)7-10/h2-7H,8H2,1H3
InChIKeyUZYPIVWTNOPSEA-UHFFFAOYSA-N
MW218.23 g/mol
LogP2.50
Rot. Bonds3

About 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine

2-[(3-fluorophenyl)methoxy]-3-methylpyrazine (PubChem CID 126954248) has the molecular formula C12H11FN2O and a molecular weight of 218.23 g/mol. Its IUPAC name is 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine.

Molecular Properties

Compound Name2-[(3-fluorophenyl)methoxy]-3-methylpyrazine
PubChem CID126954248
Molecular FormulaC12H11FN2O
Molecular Weight218.23 g/mol
Exact Mass218.09
IUPAC Name2-[(3-fluorophenyl)methoxy]-3-methylpyrazine
SMILESCc1nccnc1OCc1cccc(F)c1
InChIInChI=1S/C12H11FN2O/c1-9-12(15-6-5-14-9)16-8-10-3-2-4-11(13)7-10/h2-7H,8H2,1H3
InChIKeyUZYPIVWTNOPSEA-UHFFFAOYSA-N
XLogP2.50
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine 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

3-[(3-fluorophenyl)methoxy]pyridine
CID 18758418
3-[(3-fluorophenyl)methoxy]pyridazine
CID 171984777
8-[(3-fluorophenyl)methoxy]-3-propyl-[1,2,4]triazolo[4,3-a]pyrazine
CID 121273160
2-[(3-fluorophenyl)methoxy]-4,6-dimethyl-3-nitropyridine
CID 75452907
4-bromo-2-[(3-fluorophenyl)methoxy]pyridine
CID 124928542
3-chloro-2-[(3-fluorophenyl)methoxy]-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 151788507
4-[(3-fluorophenyl)methoxy]-3,5-dimethylbenzenesulfonamide
CID 43342485
[1-[3-[(3-fluorophenyl)methoxy]pyrazin-2-yl]-2,4,4-trimethylpentan-2-yl]urea
CID 142715655
2-bromo-1-[(3-fluorophenyl)methoxy]-4-methylbenzene
CID 28533453
4-[(3-fluorophenyl)methoxy]-3-methylaniline
CID 22137933
4-bromo-2-[(3-fluorophenyl)methoxy]-1-methylbenzene
CID 107284187
ethane;1-ethyl-3-[(3-fluorophenyl)methoxy]benzene
CID 176690950

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine?
The IUPAC name of 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine (CID 126954248) is 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine.
What is the SMILES notation for 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine?
The canonical SMILES for 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine is Cc1nccnc1OCc1cccc(F)c1.
What is the InChIKey of 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine?
The InChIKey is UZYPIVWTNOPSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O/c1-9-12(15-6-5-14-9)16-8-10-3-2-4-11(13)7-10/h2-7H,8H2,1H3.
What are the key properties of 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine?
2-[(3-fluorophenyl)methoxy]-3-methylpyrazine has a molecular weight of 218.23 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenyl)methoxy]-3-methylpyrazine is sourced from PubChem (CID 126954248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).