2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid

C7H6F2N2O3 — CID 118842760

IUPAC2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid
SMILESO=C(O)Cc1cncc(OC(F)F)n1
InChIInChI=1S/C7H6F2N2O3/c8-7(9)14-5-3-10-2-4(11-5)1-6(12)13/h2-3,7H,1H2,(H,12,13)
InChIKeySWIGZYHRJKNSMY-UHFFFAOYSA-N
MW204.13 g/mol
LogP0.71
Rot. Bonds4

About 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid

2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid (PubChem CID 118842760) has the molecular formula C7H6F2N2O3 and a molecular weight of 204.13 g/mol. Its IUPAC name is 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid
PubChem CID118842760
Molecular FormulaC7H6F2N2O3
Molecular Weight204.13 g/mol
Exact Mass204.03
IUPAC Name2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid
SMILESO=C(O)Cc1cncc(OC(F)F)n1
InChIInChI=1S/C7H6F2N2O3/c8-7(9)14-5-3-10-2-4(11-5)1-6(12)13/h2-3,7H,1H2,(H,12,13)
InChIKeySWIGZYHRJKNSMY-UHFFFAOYSA-N
XLogP0.71
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.13
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-methylpyrazin-2-yl)acetic acid
CID 82594952
2-[2-(difluoromethoxy)-5-fluoro-4-pyridinyl]acetic acid
CID 131870546
2-[4-(difluoromethoxy)-5-fluoro-2-pyridinyl]acetic acid
CID 137346925
2-pyrazin-2-ylacetic acid
CID 19797048
2-[4-(difluoromethoxy)phenyl]acetic acid
CID 2774127
2-[6-chloro-5-(difluoromethoxy)-3-pyridinyl]acetic acid
CID 119004607
2-[6-(trifluoromethoxy)-2-pyridinyl]acetic acid
CID 119023721
2-[5-chloro-2-(difluoromethoxy)-3-methylphenyl]acetic acid
CID 171005263
6-propan-2-yloxypyrazine-2-carboxylic acid
CID 65440453
N-[[6-(1,1,1-trifluoropropan-2-yloxy)pyrazin-2-yl]methyl]ethanamine
CID 66467965
2-[4-(aminomethyl)-5-chloro-6-(difluoromethyl)-2-pyridinyl]acetic acid
CID 118807335
2-[6-bromo-5-(difluoromethyl)-2-pyridinyl]acetic acid
CID 119015163

Frequently Asked Questions

What is the IUPAC name of 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid?
The IUPAC name of 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid (CID 118842760) is 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid.
What is the SMILES notation for 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid?
The canonical SMILES for 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid is O=C(O)Cc1cncc(OC(F)F)n1.
What is the InChIKey of 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid?
The InChIKey is SWIGZYHRJKNSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O3/c8-7(9)14-5-3-10-2-4(11-5)1-6(12)13/h2-3,7H,1H2,(H,12,13).
What are the key properties of 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid?
2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid has a molecular weight of 204.13 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(difluoromethoxy)pyrazin-2-yl]acetic acid is sourced from PubChem (CID 118842760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).