[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine

C14H18N4O2 — CID 80940996

IUPAC[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(Oc2ccc(C)cc2OC)n1
InChIInChI=1S/C14H18N4O2/c1-4-12-16-13(18-15)8-14(17-12)20-10-6-5-9(2)7-11(10)19-3/h5-8H,4,15H2,1-3H3,(H,16,17,18)
InChIKeyRAEKUNFIMXQHNI-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.43
Rot. Bonds5

About [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine

[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine (PubChem CID 80940996) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine
PubChem CID80940996
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(Oc2ccc(C)cc2OC)n1
InChIInChI=1S/C14H18N4O2/c1-4-12-16-13(18-15)8-14(17-12)20-10-6-5-9(2)7-11(10)19-3/h5-8H,4,15H2,1-3H3,(H,16,17,18)
InChIKeyRAEKUNFIMXQHNI-UHFFFAOYSA-N
XLogP2.43
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.43
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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Frequently Asked Questions

What is the IUPAC name of [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine (CID 80940996) is [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine is CCc1nc(NN)cc(Oc2ccc(C)cc2OC)n1.
What is the InChIKey of [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is RAEKUNFIMXQHNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-4-12-16-13(18-15)8-14(17-12)20-10-6-5-9(2)7-11(10)19-3/h5-8H,4,15H2,1-3H3,(H,16,17,18).
What are the key properties of [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine?
[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 274.32 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80940996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).