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

C8H15N3O2S — CID 79763909

IUPAC[5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESCOCCCOCc1cnc(NN)s1
InChIInChI=1S/C8H15N3O2S/c1-12-3-2-4-13-6-7-5-10-8(11-9)14-7/h5H,2-4,6,9H2,1H3,(H,10,11)
InChIKeyWZOZBDCPPFQAKZ-UHFFFAOYSA-N
MW217.29 g/mol
LogP0.98
Rot. Bonds7

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

[5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 79763909) has the molecular formula C8H15N3O2S and a molecular weight of 217.29 g/mol. Its IUPAC name is [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID79763909
Molecular FormulaC8H15N3O2S
Molecular Weight217.29 g/mol
Exact Mass217.09
IUPAC Name[5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine
SMILESCOCCCOCc1cnc(NN)s1
InChIInChI=1S/C8H15N3O2S/c1-12-3-2-4-13-6-7-5-10-8(11-9)14-7/h5H,2-4,6,9H2,1H3,(H,10,11)
InChIKeyWZOZBDCPPFQAKZ-UHFFFAOYSA-N
XLogP0.98
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine (CID 79763909) is [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine is COCCCOCc1cnc(NN)s1.
What is the InChIKey of [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is WZOZBDCPPFQAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2S/c1-12-3-2-4-13-6-7-5-10-8(11-9)14-7/h5H,2-4,6,9H2,1H3,(H,10,11).
What are the key properties of [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine?
[5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 217.29 g/mol, XLogP of 0.98, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-methoxypropoxymethyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79763909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).