2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide

C9H15N3O3S — CID 82440072

IUPAC2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide
SMILESCOCCc1nc(COC)c(C(=O)NN)s1
InChIInChI=1S/C9H15N3O3S/c1-14-4-3-7-11-6(5-15-2)8(16-7)9(13)12-10/h3-5,10H2,1-2H3,(H,12,13)
InChIKeyJKFDQYMBLFDBGG-UHFFFAOYSA-N
MW245.30 g/mol
LogP0.08
Rot. Bonds6

About 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide

2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide (PubChem CID 82440072) has the molecular formula C9H15N3O3S and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide.

Molecular Properties

Compound Name2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide
PubChem CID82440072
Molecular FormulaC9H15N3O3S
Molecular Weight245.30 g/mol
Exact Mass245.08
IUPAC Name2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide
SMILESCOCCc1nc(COC)c(C(=O)NN)s1
InChIInChI=1S/C9H15N3O3S/c1-14-4-3-7-11-6(5-15-2)8(16-7)9(13)12-10/h3-5,10H2,1-2H3,(H,12,13)
InChIKeyJKFDQYMBLFDBGG-UHFFFAOYSA-N
XLogP0.08
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide?
The IUPAC name of 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide (CID 82440072) is 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide.
What is the SMILES notation for 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide?
The canonical SMILES for 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide is COCCc1nc(COC)c(C(=O)NN)s1.
What is the InChIKey of 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide?
The InChIKey is JKFDQYMBLFDBGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3S/c1-14-4-3-7-11-6(5-15-2)8(16-7)9(13)12-10/h3-5,10H2,1-2H3,(H,12,13).
What are the key properties of 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide?
2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide has a molecular weight of 245.30 g/mol, XLogP of 0.08, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-4-(methoxymethyl)-1,3-thiazole-5-carbohydrazide is sourced from PubChem (CID 82440072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).