2-chloro-6-(3-ethoxyphenoxy)pyrazine

C12H11ClN2O2 — CID 55061194

IUPAC2-chloro-6-(3-ethoxyphenoxy)pyrazine
SMILESCCOc1cccc(Oc2cncc(Cl)n2)c1
InChIInChI=1S/C12H11ClN2O2/c1-2-16-9-4-3-5-10(6-9)17-12-8-14-7-11(13)15-12/h3-8H,2H2,1H3
InChIKeyITCINNLEDREXFF-UHFFFAOYSA-N
MW250.69 g/mol
LogP3.32
Rot. Bonds4

About 2-chloro-6-(3-ethoxyphenoxy)pyrazine

2-chloro-6-(3-ethoxyphenoxy)pyrazine (PubChem CID 55061194) has the molecular formula C12H11ClN2O2 and a molecular weight of 250.69 g/mol. Its IUPAC name is 2-chloro-6-(3-ethoxyphenoxy)pyrazine.

Molecular Properties

Compound Name2-chloro-6-(3-ethoxyphenoxy)pyrazine
PubChem CID55061194
Molecular FormulaC12H11ClN2O2
Molecular Weight250.69 g/mol
Exact Mass250.05
IUPAC Name2-chloro-6-(3-ethoxyphenoxy)pyrazine
SMILESCCOc1cccc(Oc2cncc(Cl)n2)c1
InChIInChI=1S/C12H11ClN2O2/c1-2-16-9-4-3-5-10(6-9)17-12-8-14-7-11(13)15-12/h3-8H,2H2,1H3
InChIKeyITCINNLEDREXFF-UHFFFAOYSA-N
XLogP3.32
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.69
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3-ethoxyphenoxy)pyrazin-2-amine
CID 80647483
2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine
CID 63985764
2-chloro-6-(3-ethoxyphenoxy)pyridine-4-carbonitrile
CID 83073226
4-chloro-6-(3-ethoxyphenoxy)pyrimidine
CID 55061243
2-chloro-6-(3-ethoxyphenoxy)-4-(trifluoromethyl)pyridine
CID 102715253
2-bromo-6-(3-ethoxyphenoxy)pyridine
CID 817495
2-chloro-4-(3-ethoxyphenoxy)-5-methylpyridine
CID 83266855
[6-(3-ethoxyphenoxy)-2-pyridinyl]methanol
CID 55060755
2-chloro-6-(4-methylphenoxy)pyrazine
CID 60726835
2-chloro-6-(4-chloro-3,5-dimethylphenoxy)pyrazine
CID 54915224
2-(6-bromonaphthalen-2-yl)oxy-6-chloropyrazine
CID 60707948
[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine
CID 113469599

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(3-ethoxyphenoxy)pyrazine?
The IUPAC name of 2-chloro-6-(3-ethoxyphenoxy)pyrazine (CID 55061194) is 2-chloro-6-(3-ethoxyphenoxy)pyrazine.
What is the SMILES notation for 2-chloro-6-(3-ethoxyphenoxy)pyrazine?
The canonical SMILES for 2-chloro-6-(3-ethoxyphenoxy)pyrazine is CCOc1cccc(Oc2cncc(Cl)n2)c1.
What is the InChIKey of 2-chloro-6-(3-ethoxyphenoxy)pyrazine?
The InChIKey is ITCINNLEDREXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2/c1-2-16-9-4-3-5-10(6-9)17-12-8-14-7-11(13)15-12/h3-8H,2H2,1H3.
What are the key properties of 2-chloro-6-(3-ethoxyphenoxy)pyrazine?
2-chloro-6-(3-ethoxyphenoxy)pyrazine has a molecular weight of 250.69 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(3-ethoxyphenoxy)pyrazine is sourced from PubChem (CID 55061194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).