[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine

C13H14Br2N4O2 — CID 80938302

IUPAC[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(Oc2cc(Br)c(OC)cc2Br)n1
InChIInChI=1S/C13H14Br2N4O2/c1-3-11-17-12(19-16)6-13(18-11)21-10-5-7(14)9(20-2)4-8(10)15/h4-6H,3,16H2,1-2H3,(H,17,18,19)
InChIKeySSDVXTJDMAVFAL-UHFFFAOYSA-N
MW418.09 g/mol
LogP3.65
Rot. Bonds5

About [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine

[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine (PubChem CID 80938302) has the molecular formula C13H14Br2N4O2 and a molecular weight of 418.09 g/mol. Its IUPAC name is [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
PubChem CID80938302
Molecular FormulaC13H14Br2N4O2
Molecular Weight418.09 g/mol
Exact Mass415.95
IUPAC Name[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
SMILESCCc1nc(NN)cc(Oc2cc(Br)c(OC)cc2Br)n1
InChIInChI=1S/C13H14Br2N4O2/c1-3-11-17-12(19-16)6-13(18-11)21-10-5-7(14)9(20-2)4-8(10)15/h4-6H,3,16H2,1-2H3,(H,17,18,19)
InChIKeySSDVXTJDMAVFAL-UHFFFAOYSA-N
XLogP3.65
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.09
LogP ≤ 53.65
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'}

Analyze [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-amine
CID 80937801
[6-(2,5-dibromo-4-methoxyphenoxy)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80924928
[2-ethyl-6-(2-methoxy-4-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 80940996
[6-(2-bromo-4-methylphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80940833
[2-ethyl-6-(2-fluorophenoxy)pyrimidin-4-yl]hydrazine
CID 80940358
[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine
CID 80940048
[6-(3-bromophenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80939353
(2-ethyl-6-phenoxypyrimidin-4-yl)hydrazine
CID 80939130
[6-(2-tert-butylphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80939744
[6-(5-chloro-2-methylphenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80938715
N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine
CID 80940196
[2-ethyl-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116794584

Frequently Asked Questions

What is the IUPAC name of [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine (CID 80938302) is [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine is CCc1nc(NN)cc(Oc2cc(Br)c(OC)cc2Br)n1.
What is the InChIKey of [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine?
The InChIKey is SSDVXTJDMAVFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Br2N4O2/c1-3-11-17-12(19-16)6-13(18-11)21-10-5-7(14)9(20-2)4-8(10)15/h4-6H,3,16H2,1-2H3,(H,17,18,19).
What are the key properties of [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine?
[6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine has a molecular weight of 418.09 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,5-dibromo-4-methoxyphenoxy)-2-ethylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80938302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).