2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine

C15H14F3N5O — CID 121351316

IUPAC2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine
SMILESCC1C(c2ncco2)=NC(N)=CN1Cc1cccc(C(F)(F)F)n1
InChIInChI=1S/C15H14F3N5O/c1-9-13(14-20-5-6-24-14)22-12(19)8-23(9)7-10-3-2-4-11(21-10)15(16,17)18/h2-6,8-9H,7,19H2,1H3
InChIKeyADEHCVYPDBIQAL-UHFFFAOYSA-N
MW337.31 g/mol
LogP2.54
Rot. Bonds3

About 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine

2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine (PubChem CID 121351316) has the molecular formula C15H14F3N5O and a molecular weight of 337.31 g/mol. Its IUPAC name is 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine.

Molecular Properties

Compound Name2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine
PubChem CID121351316
Molecular FormulaC15H14F3N5O
Molecular Weight337.31 g/mol
Exact Mass337.12
IUPAC Name2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine
SMILESCC1C(c2ncco2)=NC(N)=CN1Cc1cccc(C(F)(F)F)n1
InChIInChI=1S/C15H14F3N5O/c1-9-13(14-20-5-6-24-14)22-12(19)8-23(9)7-10-3-2-4-11(21-10)15(16,17)18/h2-6,8-9H,7,19H2,1H3
InChIKeyADEHCVYPDBIQAL-UHFFFAOYSA-N
XLogP2.54
TPSA80.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.31
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine?
The IUPAC name of 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine (CID 121351316) is 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine.
What is the SMILES notation for 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine?
The canonical SMILES for 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine is CC1C(c2ncco2)=NC(N)=CN1Cc1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine?
The InChIKey is ADEHCVYPDBIQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N5O/c1-9-13(14-20-5-6-24-14)22-12(19)8-23(9)7-10-3-2-4-11(21-10)15(16,17)18/h2-6,8-9H,7,19H2,1H3.
What are the key properties of 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine?
2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine has a molecular weight of 337.31 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1,3-oxazol-2-yl)-1-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-2H-pyrazin-5-amine is sourced from PubChem (CID 121351316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).