[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine

C11H11BrN4O — CID 80913487

IUPAC[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine
SMILESCc1cnc(NN)nc1Oc1ccccc1Br
InChIInChI=1S/C11H11BrN4O/c1-7-6-14-11(16-13)15-10(7)17-9-5-3-2-4-8(9)12/h2-6H,13H2,1H3,(H,14,15,16)
InChIKeyRFZOSLJSSQENMW-UHFFFAOYSA-N
MW295.14 g/mol
LogP2.63
Rot. Bonds3

About [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine

[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine (PubChem CID 80913487) has the molecular formula C11H11BrN4O and a molecular weight of 295.14 g/mol. Its IUPAC name is [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine
PubChem CID80913487
Molecular FormulaC11H11BrN4O
Molecular Weight295.14 g/mol
Exact Mass294.01
IUPAC Name[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine
SMILESCc1cnc(NN)nc1Oc1ccccc1Br
InChIInChI=1S/C11H11BrN4O/c1-7-6-14-11(16-13)15-10(7)17-9-5-3-2-4-8(9)12/h2-6H,13H2,1H3,(H,14,15,16)
InChIKeyRFZOSLJSSQENMW-UHFFFAOYSA-N
XLogP2.63
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.14
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[4-(2-methoxyphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80917253
[4-(2-ethylphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80917094
[4-(2-tert-butylphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80917311
[5-methyl-4-[(2-methyl-3-pyridinyl)oxy]pyrimidin-2-yl]hydrazine
CID 80923549
[4-(2,6-dimethoxyphenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80918360
[4-(3-bromo-4-fluorophenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 83237844
[4-(2,4-dichlorophenoxy)-5-methylpyrimidin-2-yl]hydrazine
CID 80915153
[5-bromo-4-(3-methyl-2-nitrophenoxy)pyrimidin-2-yl]hydrazine
CID 80920594
3-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-4-methylbenzonitrile
CID 107662868
3-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-N,N-dimethylaniline
CID 80920463
[5-bromo-4-(4-bromo-3,5-dimethylphenoxy)pyrimidin-2-yl]hydrazine
CID 107727403
6-(2-bromophenoxy)-5-methylpyridin-3-amine
CID 62476241

Frequently Asked Questions

What is the IUPAC name of [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine (CID 80913487) is [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine is Cc1cnc(NN)nc1Oc1ccccc1Br.
What is the InChIKey of [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine?
The InChIKey is RFZOSLJSSQENMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN4O/c1-7-6-14-11(16-13)15-10(7)17-9-5-3-2-4-8(9)12/h2-6H,13H2,1H3,(H,14,15,16).
What are the key properties of [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine?
[4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine has a molecular weight of 295.14 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-bromophenoxy)-5-methylpyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80913487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).