N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide

C11H20N4OS — CID 65271293

IUPACN,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide
SMILESCCc1nsc(NCCC(=O)N(CC)CC)n1
InChIInChI=1S/C11H20N4OS/c1-4-9-13-11(17-14-9)12-8-7-10(16)15(5-2)6-3/h4-8H2,1-3H3,(H,12,13,14)
InChIKeyWZYIWUGTDIKGNU-UHFFFAOYSA-N
MW256.37 g/mol
LogP1.77
Rot. Bonds7

About N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide

N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide (PubChem CID 65271293) has the molecular formula C11H20N4OS and a molecular weight of 256.37 g/mol. Its IUPAC name is N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide
PubChem CID65271293
Molecular FormulaC11H20N4OS
Molecular Weight256.37 g/mol
Exact Mass256.14
IUPAC NameN,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide
SMILESCCc1nsc(NCCC(=O)N(CC)CC)n1
InChIInChI=1S/C11H20N4OS/c1-4-9-13-11(17-14-9)12-8-7-10(16)15(5-2)6-3/h4-8H2,1-3H3,(H,12,13,14)
InChIKeyWZYIWUGTDIKGNU-UHFFFAOYSA-N
XLogP1.77
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[5-(Butylamino)-1,2,4-thiadiazol-3-yl]propan-2-one
CID 3317921
1-Cyclopropyl-4-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]pyrrolidin-2-one
CID 71924181
1-Tert-butyl-4-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]pyrrolidin-2-one
CID 71924183
1-Tert-butyl-4-[(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]pyrrolidin-2-one
CID 71976849
2-[4-(3-ethyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-N-propylacetamide
CID 72115341
1-Tert-butyl-4-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]pyrrolidin-2-one
CID 75376042
2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-ethylamino]-N-ethylacetamide
CID 71913844
1-[3-[(3-Ethyl-1,2,4-thiadiazol-5-yl)amino]pyrrolidin-1-yl]ethanone
CID 71918740
3-[4-(3-ethyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-N-methylpropanamide
CID 71988596
(2R)-2-amino-1-[4-(3-ethyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]propan-1-one
CID 75496009
(2S)-2-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]-N-propan-2-ylpropanamide
CID 124596954
(4S)-4-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]pyrrolidin-2-one
CID 164633149

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
The IUPAC name of N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide (CID 65271293) is N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide.
What is the SMILES notation for N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
The canonical SMILES for N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide is CCc1nsc(NCCC(=O)N(CC)CC)n1.
What is the InChIKey of N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
The InChIKey is WZYIWUGTDIKGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4OS/c1-4-9-13-11(17-14-9)12-8-7-10(16)15(5-2)6-3/h4-8H2,1-3H3,(H,12,13,14).
What are the key properties of N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide?
N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide has a molecular weight of 256.37 g/mol, XLogP of 1.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide is sourced from PubChem (CID 65271293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).