2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide

C9H16N4OS — CID 71989635

IUPAC2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
SMILESCCN(CC)CC(=O)Nc1nc(C)ns1
InChIInChI=1S/C9H16N4OS/c1-4-13(5-2)6-8(14)11-9-10-7(3)12-15-9/h4-6H2,1-3H3,(H,10,11,12,14)
InChIKeyGMCIQOIRJSWZKF-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.13
Rot. Bonds5

About 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide

2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide (PubChem CID 71989635) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
PubChem CID71989635
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide
SMILESCCN(CC)CC(=O)Nc1nc(C)ns1
InChIInChI=1S/C9H16N4OS/c1-4-13(5-2)6-8(14)11-9-10-7(3)12-15-9/h4-6H2,1-3H3,(H,10,11,12,14)
InChIKeyGMCIQOIRJSWZKF-UHFFFAOYSA-N
XLogP1.13
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
The IUPAC name of 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide (CID 71989635) is 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide.
What is the SMILES notation for 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
The canonical SMILES for 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide is CCN(CC)CC(=O)Nc1nc(C)ns1.
What is the InChIKey of 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
The InChIKey is GMCIQOIRJSWZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-4-13(5-2)6-8(14)11-9-10-7(3)12-15-9/h4-6H2,1-3H3,(H,10,11,12,14).
What are the key properties of 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide?
2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide has a molecular weight of 228.32 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-(3-methyl-1,2,4-thiadiazol-5-yl)acetamide is sourced from PubChem (CID 71989635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).