2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine

C12H10Cl2N2O — CID 54915224

IUPAC2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine
SMILESCc1cc(Oc2cncc(Cl)n2)cc(C)c1Cl
InChIInChI=1S/C12H10Cl2N2O/c1-7-3-9(4-8(2)12(7)14)17-11-6-15-5-10(13)16-11/h3-6H,1-2H3
InChIKeyDHFSJFRBRRXZMF-UHFFFAOYSA-N
MW269.13 g/mol
LogP4.19
Rot. Bonds2

About 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine

2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine (PubChem CID 54915224) has the molecular formula C12H10Cl2N2O and a molecular weight of 269.13 g/mol. Its IUPAC name is 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine.

Molecular Properties

Compound Name2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine
PubChem CID54915224
Molecular FormulaC12H10Cl2N2O
Molecular Weight269.13 g/mol
Exact Mass268.02
IUPAC Name2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine
SMILESCc1cc(Oc2cncc(Cl)n2)cc(C)c1Cl
InChIInChI=1S/C12H10Cl2N2O/c1-7-3-9(4-8(2)12(7)14)17-11-6-15-5-10(13)16-11/h3-6H,1-2H3
InChIKeyDHFSJFRBRRXZMF-UHFFFAOYSA-N
XLogP4.19
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine?
The IUPAC name of 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine (CID 54915224) is 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine.
What is the SMILES notation for 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine?
The canonical SMILES for 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine is Cc1cc(Oc2cncc(Cl)n2)cc(C)c1Cl.
What is the InChIKey of 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine?
The InChIKey is DHFSJFRBRRXZMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O/c1-7-3-9(4-8(2)12(7)14)17-11-6-15-5-10(13)16-11/h3-6H,1-2H3.
What are the key properties of 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine?
2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine has a molecular weight of 269.13 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine is sourced from PubChem (CID 54915224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).