[5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine

C10H15ClN4O — CID 106207949

IUPAC[5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine
SMILESNNc1ncc(Cl)c(OCCC2CCC2)n1
InChIInChI=1S/C10H15ClN4O/c11-8-6-13-10(15-12)14-9(8)16-5-4-7-2-1-3-7/h6-7H,1-5,12H2,(H,13,14,15)
InChIKeyXUXFVOMMBYTEJV-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.98
Rot. Bonds5

About [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine

[5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine (PubChem CID 106207949) has the molecular formula C10H15ClN4O and a molecular weight of 242.71 g/mol. Its IUPAC name is [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine
PubChem CID106207949
Molecular FormulaC10H15ClN4O
Molecular Weight242.71 g/mol
Exact Mass242.09
IUPAC Name[5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine
SMILESNNc1ncc(Cl)c(OCCC2CCC2)n1
InChIInChI=1S/C10H15ClN4O/c11-8-6-13-10(15-12)14-9(8)16-5-4-7-2-1-3-7/h6-7H,1-5,12H2,(H,13,14,15)
InChIKeyXUXFVOMMBYTEJV-UHFFFAOYSA-N
XLogP1.98
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.98
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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Frequently Asked Questions

What is the IUPAC name of [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine?
The IUPAC name of [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine (CID 106207949) is [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine is NNc1ncc(Cl)c(OCCC2CCC2)n1.
What is the InChIKey of [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine?
The InChIKey is XUXFVOMMBYTEJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4O/c11-8-6-13-10(15-12)14-9(8)16-5-4-7-2-1-3-7/h6-7H,1-5,12H2,(H,13,14,15).
What are the key properties of [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine?
[5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine has a molecular weight of 242.71 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-4-(2-cyclobutylethoxy)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 106207949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).