N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide

C15H14N4OS2 — CID 652124

IUPACN-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide
SMILESCCN(C(=O)Cc1cccs1)c1nnc(-c2cccnc2)s1
InChIInChI=1S/C15H14N4OS2/c1-2-19(13(20)9-12-6-4-8-21-12)15-18-17-14(22-15)11-5-3-7-16-10-11/h3-8,10H,2,9H2,1H3
InChIKeyGJZAGSQTLJFVRP-UHFFFAOYSA-N
MW330.44 g/mol
LogP3.26
Rot. Bonds5

About N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide

N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide (PubChem CID 652124) has the molecular formula C15H14N4OS2 and a molecular weight of 330.44 g/mol. Its IUPAC name is N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide
PubChem CID652124
Molecular FormulaC15H14N4OS2
Molecular Weight330.44 g/mol
Exact Mass330.06
IUPAC NameN-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide
SMILESCCN(C(=O)Cc1cccs1)c1nnc(-c2cccnc2)s1
InChIInChI=1S/C15H14N4OS2/c1-2-19(13(20)9-12-6-4-8-21-12)15-18-17-14(22-15)11-5-3-7-16-10-11/h3-8,10H,2,9H2,1H3
InChIKeyGJZAGSQTLJFVRP-UHFFFAOYSA-N
XLogP3.26
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.44
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-(3-Pyridinyl)-1,3,4-thiadiazol-2-YL]-2-thiophenecarboxamide
CID 1080952
1-acetyl-3-(3-pyridinyl)-N-(2-thienylmethyl)-1H-1,2,4-triazol-5-amine
CID 2980597
1-[3-Pyridin-3-yl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]propan-1-one
CID 3978169
1-[3-Pyridin-3-yl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]butan-1-one
CID 4011449
N-(2-Methoxy-ethyl)-N-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-2-thiophen-2-yl-acetamide
CID 646286
N-(2-Methoxy-ethyl)-N-(5-pyridin-3-yl-[1,3,4]thiadiazol-2-yl)-2-thiophen-2-yl-acetamide
CID 649676
N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide
CID 1245524
N-butyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 70695740
N-Cyclopentyl-3-methyl-N-(5-pyridin-3-yl-[1,3,4]thiadiazol-2-yl)-butyramide
CID 1444898
N-(2-Methoxyethyl)-N-[5-(pyridin-3-YL)-1,3,4-thiadiazol-2-YL]pentanamide
CID 3212786
N-(5-pyridin-4-yl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
CID 1246221
Thiophene-2-carboxylic acid ethyl-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-amide
CID 647461

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide (CID 652124) is N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide is CCN(C(=O)Cc1cccs1)c1nnc(-c2cccnc2)s1.
What is the InChIKey of N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide?
The InChIKey is GJZAGSQTLJFVRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4OS2/c1-2-19(13(20)9-12-6-4-8-21-12)15-18-17-14(22-15)11-5-3-7-16-10-11/h3-8,10H,2,9H2,1H3.
What are the key properties of N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide?
N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide has a molecular weight of 330.44 g/mol, XLogP of 3.26, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 652124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).