N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine

C10H13N3S2 — CID 105137529

IUPACN-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)c1cnns1
InChIInChI=1S/C10H13N3S2/c1-2-11-9(10-6-12-13-15-10)5-8-3-4-14-7-8/h3-4,6-7,9,11H,2,5H2,1H3
InChIKeyLYPUEKDQXWKHBD-UHFFFAOYSA-N
MW239.37 g/mol
LogP2.49
Rot. Bonds5

About N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine

N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine (PubChem CID 105137529) has the molecular formula C10H13N3S2 and a molecular weight of 239.37 g/mol. Its IUPAC name is N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine
PubChem CID105137529
Molecular FormulaC10H13N3S2
Molecular Weight239.37 g/mol
Exact Mass239.06
IUPAC NameN-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)c1cnns1
InChIInChI=1S/C10H13N3S2/c1-2-11-9(10-6-12-13-15-10)5-8-3-4-14-7-8/h3-4,6-7,9,11H,2,5H2,1H3
InChIKeyLYPUEKDQXWKHBD-UHFFFAOYSA-N
XLogP2.49
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(thiadiazol-5-yl)-3-thiophen-3-ylpropan-1-amine
CID 105147974
N-ethyl-3-methyl-1-(thiadiazol-5-yl)butan-1-amine
CID 105083153
N-[2-(4-ethylphenyl)-1-(thiadiazol-5-yl)ethyl]propan-1-amine
CID 105101683
N-ethyl-1-(thiadiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105177958
N-ethyl-2-(1-methylpyrazol-3-yl)-1-(thiadiazol-5-yl)ethanamine
CID 105175015
N-ethyl-1-(4-iodophenyl)-2-thiophen-3-ylethanamine
CID 61078389
N-ethyl-1-(thiadiazol-5-yl)hexan-1-amine
CID 105129677
N-[2-(4-fluorophenyl)-1-(thiadiazol-5-yl)ethyl]propan-1-amine
CID 105087093
4-[1-(ethylamino)-2-thiophen-3-ylethyl]-N,N-dimethylaniline
CID 105137654
N-ethyl-1-(2-iodophenyl)-2-thiophen-3-ylethanamine
CID 61078733
N-ethyl-1-isoquinolin-4-yl-2-thiophen-3-ylethanamine
CID 105147369
1-(4-chloro-1-ethylpyrazol-5-yl)-N-ethyl-2-thiophen-3-ylethanamine
CID 105183136

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine?
The IUPAC name of N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine (CID 105137529) is N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine?
The canonical SMILES for N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine is CCNC(Cc1ccsc1)c1cnns1.
What is the InChIKey of N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine?
The InChIKey is LYPUEKDQXWKHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S2/c1-2-11-9(10-6-12-13-15-10)5-8-3-4-14-7-8/h3-4,6-7,9,11H,2,5H2,1H3.
What are the key properties of N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine?
N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine has a molecular weight of 239.37 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(thiadiazol-5-yl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 105137529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).