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

C10H19N3OS — CID 79764282

IUPAC[5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESCCCCCCOCc1cnc(NN)s1
InChIInChI=1S/C10H19N3OS/c1-2-3-4-5-6-14-8-9-7-12-10(13-11)15-9/h7H,2-6,8,11H2,1H3,(H,12,13)
InChIKeyHKAKPKGQNXXRTM-UHFFFAOYSA-N
MW229.35 g/mol
LogP2.53
Rot. Bonds8

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

[5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79764282) has the molecular formula C10H19N3OS and a molecular weight of 229.35 g/mol. Its IUPAC name is [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79764282
Molecular FormulaC10H19N3OS
Molecular Weight229.35 g/mol
Exact Mass229.12
IUPAC Name[5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESCCCCCCOCc1cnc(NN)s1
InChIInChI=1S/C10H19N3OS/c1-2-3-4-5-6-14-8-9-7-12-10(13-11)15-9/h7H,2-6,8,11H2,1H3,(H,12,13)
InChIKeyHKAKPKGQNXXRTM-UHFFFAOYSA-N
XLogP2.53
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79764282) is [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine is CCCCCCOCc1cnc(NN)s1.
What is the InChIKey of [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is HKAKPKGQNXXRTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3OS/c1-2-3-4-5-6-14-8-9-7-12-10(13-11)15-9/h7H,2-6,8,11H2,1H3,(H,12,13).
What are the key properties of [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 229.35 g/mol, XLogP of 2.53, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(hexoxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79764282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).