4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine

C10H6ClF3N4O — CID 106769030

IUPAC4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine
SMILESCOc1nccnc1-c1cc(Cl)nc(C(F)(F)F)n1
InChIInChI=1S/C10H6ClF3N4O/c1-19-8-7(15-2-3-16-8)5-4-6(11)18-9(17-5)10(12,13)14/h2-4H,1H3
InChIKeyZXPLYILVWVFASL-UHFFFAOYSA-N
MW290.63 g/mol
LogP2.61
Rot. Bonds2

About 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine

4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine (PubChem CID 106769030) has the molecular formula C10H6ClF3N4O and a molecular weight of 290.63 g/mol. Its IUPAC name is 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine.

Molecular Properties

Compound Name4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine
PubChem CID106769030
Molecular FormulaC10H6ClF3N4O
Molecular Weight290.63 g/mol
Exact Mass290.02
IUPAC Name4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine
SMILESCOc1nccnc1-c1cc(Cl)nc(C(F)(F)F)n1
InChIInChI=1S/C10H6ClF3N4O/c1-19-8-7(15-2-3-16-8)5-4-6(11)18-9(17-5)10(12,13)14/h2-4H,1H3
InChIKeyZXPLYILVWVFASL-UHFFFAOYSA-N
XLogP2.61
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.63
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine
CID 104516547
2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine
CID 104516561
4-chloro-6-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)pyrimidine
CID 106768889
6-chloro-N-[(4-methoxyphenyl)methyl]-2-(trifluoromethyl)pyrimidin-4-amine
CID 106767088
4-chloro-6-ethoxy-2-(trifluoromethyl)pyrimidine
CID 106766587
4-chloro-2-(trifluoromethyl)-6-(2,4,5-trifluorophenyl)pyrimidine
CID 106768991
4-chloro-2-(3-methoxypyrazin-2-yl)-1,3-thiazole
CID 104516513
4-chloro-6-(2,3-dimethylphenyl)-2-(trifluoromethyl)pyrimidine
CID 106768869
2-methoxy-3-pyridin-2-ylpyrazine
CID 91147636
4-chloro-6-methylsulfanyl-2-(trifluoromethyl)pyrimidine
CID 106768685
4-chloro-6-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)pyrimidine
CID 106768965
2-tert-butyl-4-chloro-6-(2,6-dimethoxyphenyl)pyrimidine
CID 116811210

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine?
The IUPAC name of 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine (CID 106769030) is 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine.
What is the SMILES notation for 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine?
The canonical SMILES for 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine is COc1nccnc1-c1cc(Cl)nc(C(F)(F)F)n1.
What is the InChIKey of 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine?
The InChIKey is ZXPLYILVWVFASL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF3N4O/c1-19-8-7(15-2-3-16-8)5-4-6(11)18-9(17-5)10(12,13)14/h2-4H,1H3.
What are the key properties of 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine?
4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine has a molecular weight of 290.63 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine is sourced from PubChem (CID 106769030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).