[5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine

C8H13N3OS — CID 79764025

IUPAC[5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COC2CCC2)s1
InChIInChI=1S/C8H13N3OS/c9-11-8-10-4-7(13-8)5-12-6-2-1-3-6/h4,6H,1-3,5,9H2,(H,10,11)
InChIKeyONTQAOKKBVGRKE-UHFFFAOYSA-N
MW199.28 g/mol
LogP1.50
Rot. Bonds4

About [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine

[5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79764025) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79764025
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC Name[5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COC2CCC2)s1
InChIInChI=1S/C8H13N3OS/c9-11-8-10-4-7(13-8)5-12-6-2-1-3-6/h4,6H,1-3,5,9H2,(H,10,11)
InChIKeyONTQAOKKBVGRKE-UHFFFAOYSA-N
XLogP1.50
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 51.50
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-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79764025) is [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine is NNc1ncc(COC2CCC2)s1.
What is the InChIKey of [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is ONTQAOKKBVGRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c9-11-8-10-4-7(13-8)5-12-6-2-1-3-6/h4,6H,1-3,5,9H2,(H,10,11).
What are the key properties of [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 199.28 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclobutyloxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79764025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).