N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine

C11H20N4OS — CID 55046502

IUPACN-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine
SMILESCCNc1snnc1CN1CCOC(CC)C1
InChIInChI=1S/C11H20N4OS/c1-3-9-7-15(5-6-16-9)8-10-11(12-4-2)17-14-13-10/h9,12H,3-8H2,1-2H3
InChIKeyMKHASKJBQNDVJH-UHFFFAOYSA-N
MW256.37 g/mol
LogP1.58
Rot. Bonds5

About N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine

N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine (PubChem CID 55046502) has the molecular formula C11H20N4OS and a molecular weight of 256.37 g/mol. Its IUPAC name is N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine.

Molecular Properties

Compound NameN-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine
PubChem CID55046502
Molecular FormulaC11H20N4OS
Molecular Weight256.37 g/mol
Exact Mass256.14
IUPAC NameN-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine
SMILESCCNc1snnc1CN1CCOC(CC)C1
InChIInChI=1S/C11H20N4OS/c1-3-9-7-15(5-6-16-9)8-10-11(12-4-2)17-14-13-10/h9,12H,3-8H2,1-2H3
InChIKeyMKHASKJBQNDVJH-UHFFFAOYSA-N
XLogP1.58
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine 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 N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine?
The IUPAC name of N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine (CID 55046502) is N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine.
What is the SMILES notation for N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine?
The canonical SMILES for N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine is CCNc1snnc1CN1CCOC(CC)C1.
What is the InChIKey of N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine?
The InChIKey is MKHASKJBQNDVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4OS/c1-3-9-7-15(5-6-16-9)8-10-11(12-4-2)17-14-13-10/h9,12H,3-8H2,1-2H3.
What are the key properties of N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine?
N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine has a molecular weight of 256.37 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(2-ethylmorpholin-4-yl)methyl]thiadiazol-5-amine is sourced from PubChem (CID 55046502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).