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

C8H15N3OS — CID 79763907

IUPAC[5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESCCC(C)OCc1cnc(NN)s1
InChIInChI=1S/C8H15N3OS/c1-3-6(2)12-5-7-4-10-8(11-9)13-7/h4,6H,3,5,9H2,1-2H3,(H,10,11)
InChIKeyJUXMSKPYPAPFIN-UHFFFAOYSA-N
MW201.29 g/mol
LogP1.74
Rot. Bonds5

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

[5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79763907) has the molecular formula C8H15N3OS and a molecular weight of 201.29 g/mol. Its IUPAC name is [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79763907
Molecular FormulaC8H15N3OS
Molecular Weight201.29 g/mol
Exact Mass201.09
IUPAC Name[5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESCCC(C)OCc1cnc(NN)s1
InChIInChI=1S/C8H15N3OS/c1-3-6(2)12-5-7-4-10-8(11-9)13-7/h4,6H,3,5,9H2,1-2H3,(H,10,11)
InChIKeyJUXMSKPYPAPFIN-UHFFFAOYSA-N
XLogP1.74
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 51.74
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-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79763907) is [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine is CCC(C)OCc1cnc(NN)s1.
What is the InChIKey of [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is JUXMSKPYPAPFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3OS/c1-3-6(2)12-5-7-4-10-8(11-9)13-7/h4,6H,3,5,9H2,1-2H3,(H,10,11).
What are the key properties of [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 201.29 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(butan-2-yloxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79763907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).