2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine

C12H11ClN2O2 — CID 63985764

IUPAC2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine
SMILESCOCc1cccc(Oc2cncc(Cl)n2)c1
InChIInChI=1S/C12H11ClN2O2/c1-16-8-9-3-2-4-10(5-9)17-12-7-14-6-11(13)15-12/h2-7H,8H2,1H3
InChIKeyKBBXRNQHQITLOR-UHFFFAOYSA-N
MW250.69 g/mol
LogP3.07
Rot. Bonds4

About 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine

2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine (PubChem CID 63985764) has the molecular formula C12H11ClN2O2 and a molecular weight of 250.69 g/mol. Its IUPAC name is 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine.

Molecular Properties

Compound Name2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine
PubChem CID63985764
Molecular FormulaC12H11ClN2O2
Molecular Weight250.69 g/mol
Exact Mass250.05
IUPAC Name2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine
SMILESCOCc1cccc(Oc2cncc(Cl)n2)c1
InChIInChI=1S/C12H11ClN2O2/c1-16-8-9-3-2-4-10(5-9)17-12-7-14-6-11(13)15-12/h2-7H,8H2,1H3
InChIKeyKBBXRNQHQITLOR-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-6-[3-(methoxymethyl)phenoxy]-2-methylpyrimidine
CID 63986769
2-chloro-6-(3-ethoxyphenoxy)pyrazine
CID 55061194
5-chloro-2-[3-(methoxymethyl)phenoxy]pyridine-4-carboxylic acid
CID 114916937
2-[3-(methoxymethyl)phenoxy]-5-methylpyridine
CID 123576631
2-[3-(methoxymethyl)phenoxy]pyridine
CID 174239052
6-[3-(methoxymethyl)phenoxy]-N-methylpyridin-2-amine
CID 80876349
[6-[3-(methoxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63986464
2-(3-ethylphenoxy)-6-methylpyrazine
CID 126676392
1-[5-chloro-2-[3-(methoxymethyl)phenoxy]-4-pyridinyl]-N-methylmethanamine
CID 114928698
2-chloro-6-(4-fluoro-3-methoxyphenoxy)pyrazine
CID 146289892
6-[3-(methoxymethyl)phenoxy]pyridine-2-carbothioamide
CID 64593563
2-ethyl-6-[3-(methoxymethyl)phenoxy]pyrimidin-4-amine
CID 80941964

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine?
The IUPAC name of 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine (CID 63985764) is 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine.
What is the SMILES notation for 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine?
The canonical SMILES for 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine is COCc1cccc(Oc2cncc(Cl)n2)c1.
What is the InChIKey of 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine?
The InChIKey is KBBXRNQHQITLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2/c1-16-8-9-3-2-4-10(5-9)17-12-7-14-6-11(13)15-12/h2-7H,8H2,1H3.
What are the key properties of 2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine?
2-chloro-6-[3-(methoxymethyl)phenoxy]pyrazine has a molecular weight of 250.69 g/mol, XLogP of 3.07, 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-(methoxymethyl)phenoxy]pyrazine is sourced from PubChem (CID 63985764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).