3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine

C9H16N4OS — CID 65267561

IUPAC3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine
SMILESCc1nsc(NCCN2CCOCC2)n1
InChIInChI=1S/C9H16N4OS/c1-8-11-9(15-12-8)10-2-3-13-4-6-14-7-5-13/h2-7H2,1H3,(H,10,11,12)
InChIKeyKLOUTZWSJMHBJO-UHFFFAOYSA-N
MW228.32 g/mol
LogP0.59
Rot. Bonds4

About 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine

3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 65267561) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine
PubChem CID65267561
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine
SMILESCc1nsc(NCCN2CCOCC2)n1
InChIInChI=1S/C9H16N4OS/c1-8-11-9(15-12-8)10-2-3-13-4-6-14-7-5-13/h2-7H2,1H3,(H,10,11,12)
InChIKeyKLOUTZWSJMHBJO-UHFFFAOYSA-N
XLogP0.59
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-methyl-N-(4-morpholin-4-ylbutyl)-1,2,4-thiadiazol-5-amine
CID 132380131
N-(2-morpholin-4-ylethyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107304684
N-(3-morpholin-4-ylpropyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107304700
N-(1-morpholin-4-ylpropan-2-yl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107304840
N-[(4-methylmorpholin-2-yl)methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107305031
N-[(4-ethylmorpholin-2-yl)methyl]-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107305195
N-(2-methoxyethyl)-N'-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]ethane-1,2-diamine
CID 107305482
N-(morpholin-3-ylmethyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107305520
N-[[4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-3-yl]methyl]ethanamine
CID 107305974
N-methyl-1-[4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-3-yl]methanamine
CID 107305975
N-[[4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-3-yl]methyl]propan-1-amine
CID 107305976
N-[[4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-3-yl]methyl]propan-2-amine
CID 107305979

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine (CID 65267561) is 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine is Cc1nsc(NCCN2CCOCC2)n1.
What is the InChIKey of 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is KLOUTZWSJMHBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-8-11-9(15-12-8)10-2-3-13-4-6-14-7-5-13/h2-7H2,1H3,(H,10,11,12).
What are the key properties of 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine?
3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 228.32 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65267561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).