[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine

C9H13BrN4O — CID 106207875

IUPAC[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine
SMILESNNc1ncnc(OCCC2CC2)c1Br
InChIInChI=1S/C9H13BrN4O/c10-7-8(14-11)12-5-13-9(7)15-4-3-6-1-2-6/h5-6H,1-4,11H2,(H,12,13,14)
InChIKeyIIJZDISTIBDEHD-UHFFFAOYSA-N
MW273.13 g/mol
LogP1.70
Rot. Bonds5

About [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine

[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine (PubChem CID 106207875) has the molecular formula C9H13BrN4O and a molecular weight of 273.13 g/mol. Its IUPAC name is [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine
PubChem CID106207875
Molecular FormulaC9H13BrN4O
Molecular Weight273.13 g/mol
Exact Mass272.03
IUPAC Name[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine
SMILESNNc1ncnc(OCCC2CC2)c1Br
InChIInChI=1S/C9H13BrN4O/c10-7-8(14-11)12-5-13-9(7)15-4-3-6-1-2-6/h5-6H,1-4,11H2,(H,12,13,14)
InChIKeyIIJZDISTIBDEHD-UHFFFAOYSA-N
XLogP1.70
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.13
LogP ≤ 51.70
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'}

Analyze [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-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

5-bromo-6-(2-cyclopropylethoxy)-N-ethylpyrimidin-4-amine
CID 106207427
6-(2-cyclopropylethoxy)-N,5-diethylpyrimidin-4-amine
CID 106207529
(5-bromo-6-cyclopropylpyrimidin-4-yl)hydrazine
CID 155858535
6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine
CID 114158214
4-(2-cyclopropylethoxy)pyrimidin-5-amine
CID 106199537
N-(2-cyclopropylethyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80924360
6-(2-cyclobutylethoxy)-5-methoxy-N-methylpyrimidin-4-amine
CID 106207741
[6-(2-cyclobutylethoxy)-3,5-difluoro-2-pyridinyl]hydrazine
CID 106207933
4-(2-cyclopropylethoxy)-6-propan-2-yloxypyrimidin-5-amine
CID 106199609
6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine
CID 106207430
6-(2-cyclobutylethoxy)-N,5-dipropylpyrimidin-4-amine
CID 106207776
6-(2-cyclobutylethoxy)-5-methoxy-N-propylpyrimidin-4-amine
CID 106207740

Frequently Asked Questions

What is the IUPAC name of [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine (CID 106207875) is [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine is NNc1ncnc(OCCC2CC2)c1Br.
What is the InChIKey of [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is IIJZDISTIBDEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN4O/c10-7-8(14-11)12-5-13-9(7)15-4-3-6-1-2-6/h5-6H,1-4,11H2,(H,12,13,14).
What are the key properties of [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine?
[5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 273.13 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-bromo-6-(2-cyclopropylethoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 106207875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).