[3-(2-fluorophenoxy)pyrazin-2-yl]methanamine

C11H10FN3O — CID 62672553

IUPAC[3-(2-fluorophenoxy)pyrazin-2-yl]methanamine
SMILESNCc1nccnc1Oc1ccccc1F
InChIInChI=1S/C11H10FN3O/c12-8-3-1-2-4-10(8)16-11-9(7-13)14-5-6-15-11/h1-6H,7,13H2
InChIKeyKZIPBFSXUXELRQ-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.87
Rot. Bonds3

About [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine

[3-(2-fluorophenoxy)pyrazin-2-yl]methanamine (PubChem CID 62672553) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine.

Molecular Properties

Compound Name[3-(2-fluorophenoxy)pyrazin-2-yl]methanamine
PubChem CID62672553
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name[3-(2-fluorophenoxy)pyrazin-2-yl]methanamine
SMILESNCc1nccnc1Oc1ccccc1F
InChIInChI=1S/C11H10FN3O/c12-8-3-1-2-4-10(8)16-11-9(7-13)14-5-6-15-11/h1-6H,7,13H2
InChIKeyKZIPBFSXUXELRQ-UHFFFAOYSA-N
XLogP1.87
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(3,4-difluorophenoxy)pyrazin-2-yl]methanamine
CID 62684336
methyl 3-(2-fluorophenoxy)pyrazine-2-carboxylate
CID 141407596
[5-bromo-2-(2-fluorophenoxy)-3-pyridinyl]methanamine
CID 62298344
[2-[(2-fluorophenoxy)methyl]-3-pyridinyl]methanamine
CID 114199215
[2-fluoro-6-(2-fluorophenoxy)phenyl]methanamine
CID 79516548
[1-(2-fluorophenoxy)isoquinolin-3-yl]methanamine
CID 62298170
[3-(2-tert-butyl-4-methylphenoxy)pyrazin-2-yl]methanamine
CID 62674098
1,2-bis[2-[2-(2-fluorophenoxy)phenoxy]phenoxy]benzene
CID 22338502
[4-[3-(aminomethyl)pyrazin-2-yl]oxy-3-methoxyphenyl]methanol
CID 107742464
[3-(5-bromo-2,3-difluorophenoxy)-2-pyridinyl]methanamine
CID 107097306
[2-[(3-bromo-4-methyl-2-pyridinyl)oxy]-6-fluorophenyl]methanamine
CID 106878446
[3-[3-(methoxymethyl)phenoxy]pyrazin-2-yl]methanamine
CID 63984754

Frequently Asked Questions

What is the IUPAC name of [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine?
The IUPAC name of [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine (CID 62672553) is [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine.
What is the SMILES notation for [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine?
The canonical SMILES for [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine is NCc1nccnc1Oc1ccccc1F.
What is the InChIKey of [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine?
The InChIKey is KZIPBFSXUXELRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c12-8-3-1-2-4-10(8)16-11-9(7-13)14-5-6-15-11/h1-6H,7,13H2.
What are the key properties of [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine?
[3-(2-fluorophenoxy)pyrazin-2-yl]methanamine has a molecular weight of 219.22 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluorophenoxy)pyrazin-2-yl]methanamine is sourced from PubChem (CID 62672553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).