[(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine

C9H18N6S — CID 106446511

IUPAC[(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
SMILESCN1CCSCC1C(NN)c1cnnn1C
InChIInChI=1S/C9H18N6S/c1-14-3-4-16-6-8(14)9(12-10)7-5-11-13-15(7)2/h5,8-9,12H,3-4,6,10H2,1-2H3
InChIKeySCSBDKWXGXQMRA-UHFFFAOYSA-N
MW242.35 g/mol
LogP-0.63
Rot. Bonds3

About [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine

[(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine (PubChem CID 106446511) has the molecular formula C9H18N6S and a molecular weight of 242.35 g/mol. Its IUPAC name is [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
PubChem CID106446511
Molecular FormulaC9H18N6S
Molecular Weight242.35 g/mol
Exact Mass242.13
IUPAC Name[(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
SMILESCN1CCSCC1C(NN)c1cnnn1C
InChIInChI=1S/C9H18N6S/c1-14-3-4-16-6-8(14)9(12-10)7-5-11-13-15(7)2/h5,8-9,12H,3-4,6,10H2,1-2H3
InChIKeySCSBDKWXGXQMRA-UHFFFAOYSA-N
XLogP-0.63
TPSA72.00 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine 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 [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine (CID 106446511) is [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine is CN1CCSCC1C(NN)c1cnnn1C.
What is the InChIKey of [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The InChIKey is SCSBDKWXGXQMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N6S/c1-14-3-4-16-6-8(14)9(12-10)7-5-11-13-15(7)2/h5,8-9,12H,3-4,6,10H2,1-2H3.
What are the key properties of [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
[(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine has a molecular weight of 242.35 g/mol, XLogP of -0.63, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-methylthiomorpholin-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 106446511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).