2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide

C14H26N4OS — CID 3076723

IUPAC2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCCCCN(CCCC)CC(=O)Nc1nnc(CC)s1
InChIInChI=1S/C14H26N4OS/c1-4-7-9-18(10-8-5-2)11-12(19)15-14-17-16-13(6-3)20-14/h4-11H2,1-3H3,(H,15,17,19)
InChIKeyIIEHOWGKHUGEHD-UHFFFAOYSA-N
MW298.46 g/mol
LogP2.94
Rot. Bonds10

About 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide

2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 3076723) has the molecular formula C14H26N4OS and a molecular weight of 298.46 g/mol. Its IUPAC name is 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID3076723
Molecular FormulaC14H26N4OS
Molecular Weight298.46 g/mol
Exact Mass298.18
IUPAC Name2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCCCCN(CCCC)CC(=O)Nc1nnc(CC)s1
InChIInChI=1S/C14H26N4OS/c1-4-7-9-18(10-8-5-2)11-12(19)15-14-17-16-13(6-3)20-14/h4-11H2,1-3H3,(H,15,17,19)
InChIKeyIIEHOWGKHUGEHD-UHFFFAOYSA-N
XLogP2.94
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.46
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(diethylamino)ethyl]-N'-(5-propyl-1,3,4-thiadiazol-2-yl)ethanediamide
CID 1860900
Acetamide, 2-(dimethylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-
CID 1091545
4-Morpholineacetamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-
CID 1219971
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[4-(methylsulfonyl)piperazin-1-yl]acetamide
CID 17376136
1-Piperidineacetamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-
CID 787680
4-Morpholineacetamide, N-(5-propyl-1,3,4-thiadiazol-2-yl)-
CID 652903
Acetamide, 2-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-
CID 1091546
2-(4-Methyl-piperazin-1-yl)-N-(5-propyl-[1,3,4]thiadiazol-2-yl)-acetamide
CID 2960408
2-Morpholin-4-yl-N-(5-propyl-[1,3,4]thiadiazol-2-yl)-acetamide
CID 6602679
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(4-propylpiperazin-1-yl)acetamide
CID 6465732
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(4-propylpiperazin-1-yl)acetamide
CID 6465949
2-(4-ethylpiperazin-1-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
CID 6467563

Frequently Asked Questions

What is the IUPAC name of 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide (CID 3076723) is 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide is CCCCN(CCCC)CC(=O)Nc1nnc(CC)s1.
What is the InChIKey of 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is IIEHOWGKHUGEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4OS/c1-4-7-9-18(10-8-5-2)11-12(19)15-14-17-16-13(6-3)20-14/h4-11H2,1-3H3,(H,15,17,19).
What are the key properties of 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide?
2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 298.46 g/mol, XLogP of 2.94, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dibutylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 3076723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).