[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine

C13H16N4O2 — CID 80940048

IUPAC[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(Oc2cccc(OC)c2)n1
InChIInChI=1S/C13H16N4O2/c1-3-11-15-12(17-14)8-13(16-11)19-10-6-4-5-9(7-10)18-2/h4-8H,3,14H2,1-2H3,(H,15,16,17)
InChIKeyBFRWQFTTWFOHSB-UHFFFAOYSA-N
MW260.30 g/mol
LogP2.13
Rot. Bonds5

About [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine

[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine (PubChem CID 80940048) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine
PubChem CID80940048
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(Oc2cccc(OC)c2)n1
InChIInChI=1S/C13H16N4O2/c1-3-11-15-12(17-14)8-13(16-11)19-10-6-4-5-9(7-10)18-2/h4-8H,3,14H2,1-2H3,(H,15,16,17)
InChIKeyBFRWQFTTWFOHSB-UHFFFAOYSA-N
XLogP2.13
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-6-(3-methoxyphenoxy)-N-methylpyrimidin-4-amine
CID 80942141
(2-ethyl-6-phenoxypyrimidin-4-yl)hydrazine
CID 80939130
[6-(3-bromophenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80939353
[6-(3-methylphenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947768
(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine
CID 80946591
4-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxybenzonitrile
CID 80939564
[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 80940996
[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80938302
[2-ethyl-6-(2-phenoxyethoxy)pyrimidin-4-yl]hydrazine
CID 80939342
6-(3-bromophenoxy)-2-ethyl-N-methylpyrimidin-4-amine
CID 80941647
[2-ethyl-6-(2-fluorophenoxy)pyrimidin-4-yl]hydrazine
CID 80940358
[2-ethyl-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116794584

Frequently Asked Questions

What is the IUPAC name of [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine (CID 80940048) is [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine is CCc1nc(NN)cc(Oc2cccc(OC)c2)n1.
What is the InChIKey of [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is BFRWQFTTWFOHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-3-11-15-12(17-14)8-13(16-11)19-10-6-4-5-9(7-10)18-2/h4-8H,3,14H2,1-2H3,(H,15,16,17).
What are the key properties of [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine?
[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 260.30 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80940048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).