[5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol

C12H11FN2O2 — CID 146526310

IUPAC[5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol
SMILESCc1ccc(Oc2cnc(CO)cn2)c(F)c1
InChIInChI=1S/C12H11FN2O2/c1-8-2-3-11(10(13)4-8)17-12-6-14-9(7-16)5-15-12/h2-6,16H,7H2,1H3
InChIKeyYFCGPGIXBYLYPQ-UHFFFAOYSA-N
MW234.23 g/mol
LogP2.21
Rot. Bonds3

About [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol

[5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol (PubChem CID 146526310) has the molecular formula C12H11FN2O2 and a molecular weight of 234.23 g/mol. Its IUPAC name is [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol
PubChem CID146526310
Molecular FormulaC12H11FN2O2
Molecular Weight234.23 g/mol
Exact Mass234.08
IUPAC Name[5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol
SMILESCc1ccc(Oc2cnc(CO)cn2)c(F)c1
InChIInChI=1S/C12H11FN2O2/c1-8-2-3-11(10(13)4-8)17-12-6-14-9(7-16)5-15-12/h2-6,16H,7H2,1H3
InChIKeyYFCGPGIXBYLYPQ-UHFFFAOYSA-N
XLogP2.21
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol?
The IUPAC name of [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol (CID 146526310) is [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol.
What is the SMILES notation for [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol?
The canonical SMILES for [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol is Cc1ccc(Oc2cnc(CO)cn2)c(F)c1.
What is the InChIKey of [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol?
The InChIKey is YFCGPGIXBYLYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O2/c1-8-2-3-11(10(13)4-8)17-12-6-14-9(7-16)5-15-12/h2-6,16H,7H2,1H3.
What are the key properties of [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol?
[5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol has a molecular weight of 234.23 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-fluoro-4-methylphenoxy)pyrazin-2-yl]methanol is sourced from PubChem (CID 146526310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).