5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine

C9H16N4OS — CID 79021672

IUPAC5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
SMILESCC1CN(Cc2nnc(N)s2)CC(C)O1
InChIInChI=1S/C9H16N4OS/c1-6-3-13(4-7(2)14-6)5-8-11-12-9(10)15-8/h6-7H,3-5H2,1-2H3,(H2,10,12)
InChIKeyWDLWHCDDQXZIEY-UHFFFAOYSA-N
MW228.32 g/mol
LogP0.73
Rot. Bonds2

About 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine

5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine (PubChem CID 79021672) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
PubChem CID79021672
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
SMILESCC1CN(Cc2nnc(N)s2)CC(C)O1
InChIInChI=1S/C9H16N4OS/c1-6-3-13(4-7(2)14-6)5-8-11-12-9(10)15-8/h6-7H,3-5H2,1-2H3,(H2,10,12)
InChIKeyWDLWHCDDQXZIEY-UHFFFAOYSA-N
XLogP0.73
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

5-(2-Morpholin-4-yl-ethyl)-[1,3,4]thiadiazol-2-ylamine
CID 3164058
5-(4-Morpholinylmethyl)-1,3,4-thiadiazol-2-ylamine
CID 22397179
5-(2-Methyl-1-morpholin-4-ylpropan-2-yl)-1,3,4-thiadiazol-2-amine
CID 68831519
5-methyl-N-(1-morpholin-4-ylpropan-2-yl)-1,3,4-thiadiazol-2-amine
CID 64915768
5-methyl-N-[(4-methylmorpholin-2-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 79003421
5-[[Bis(2-methoxyethyl)amino]methyl]-1,3,4-thiadiazol-2-amine
CID 79021831
2-[4-[(5-Amino-1,3,4-thiadiazol-2-yl)methyl]piperazin-1-yl]ethanol
CID 79021905
N-methyl-5-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 80606096
N-ethyl-5-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 80606097
5-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 80606107
N-ethyl-5-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 80606108
5-[(2,6-dimethylmorpholin-4-yl)methyl]-N-propyl-1,3,4-thiadiazol-2-amine
CID 80606159

Frequently Asked Questions

What is the IUPAC name of 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine (CID 79021672) is 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine is CC1CN(Cc2nnc(N)s2)CC(C)O1.
What is the InChIKey of 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine?
The InChIKey is WDLWHCDDQXZIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-6-3-13(4-7(2)14-6)5-8-11-12-9(10)15-8/h6-7H,3-5H2,1-2H3,(H2,10,12).
What are the key properties of 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine?
5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine has a molecular weight of 228.32 g/mol, XLogP of 0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 79021672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).