3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine

C14H15ClN2O2 — CID 63271999

IUPAC3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine
SMILESCCOc1ccccc1Oc1nnc(Cl)c(C)c1C
InChIInChI=1S/C14H15ClN2O2/c1-4-18-11-7-5-6-8-12(11)19-14-10(3)9(2)13(15)16-17-14/h5-8H,4H2,1-3H3
InChIKeyOPIORKSRMQPRAX-UHFFFAOYSA-N
MW278.74 g/mol
LogP3.94
Rot. Bonds4

About 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine

3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine (PubChem CID 63271999) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine.

Molecular Properties

Compound Name3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine
PubChem CID63271999
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine
SMILESCCOc1ccccc1Oc1nnc(Cl)c(C)c1C
InChIInChI=1S/C14H15ClN2O2/c1-4-18-11-7-5-6-8-12(11)19-14-10(3)9(2)13(15)16-17-14/h5-8H,4H2,1-3H3
InChIKeyOPIORKSRMQPRAX-UHFFFAOYSA-N
XLogP3.94
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-6-(4-ethoxyphenoxy)-4,5-dimethylpyridazine
CID 63271914
3-chloro-6-(2,6-dimethoxyphenoxy)-4,5-dimethylpyridazine
CID 63271828
[3-(2-ethoxyphenoxy)-5,6-dimethylpyridazin-4-yl]methanamine
CID 61096422
3-chloro-5-methoxy-6-(2-methoxyphenoxy)-4-methylpyridazine
CID 141062507
3-chloro-6-(4-fluorophenoxy)-4,5-dimethylpyridazine
CID 55168912
2,4-dichloro-6-(2-ethoxyphenoxy)-1,3,5-triazine
CID 62858074
4-chloro-6-(2-ethoxyphenoxy)-5-propylpyrimidine
CID 63734858
3-chloro-6-(2,4-dichlorophenoxy)-4,5-dimethylpyridazine
CID 55168913
3-(2-bromo-4-fluorophenoxy)-6-chloro-4,5-dimethylpyridazine
CID 55168907
2-chloro-4-(2-ethoxyphenoxy)-6-methylpyrimidine
CID 55080992
sodium 2-ethoxyphenolate
CID 23671657
2-bromo-5-(2-ethoxyphenoxy)-1,3,4-thiadiazole
CID 64623652

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine?
The IUPAC name of 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine (CID 63271999) is 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine.
What is the SMILES notation for 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine?
The canonical SMILES for 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine is CCOc1ccccc1Oc1nnc(Cl)c(C)c1C.
What is the InChIKey of 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine?
The InChIKey is OPIORKSRMQPRAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c1-4-18-11-7-5-6-8-12(11)19-14-10(3)9(2)13(15)16-17-14/h5-8H,4H2,1-3H3.
What are the key properties of 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine?
3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine has a molecular weight of 278.74 g/mol, XLogP of 3.94, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(2-ethoxyphenoxy)-4,5-dimethylpyridazine is sourced from PubChem (CID 63271999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).