4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide

C16H19N3O2S2 — CID 121496273

IUPAC4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
SMILESO=C(NCCc1cccs1)N1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C16H19N3O2S2/c20-15(14-4-2-12-23-14)18-7-9-19(10-8-18)16(21)17-6-5-13-3-1-11-22-13/h1-4,11-12H,5-10H2,(H,17,21)
InChIKeyZQTHJMSWUCQSDO-UHFFFAOYSA-N
MW349.48 g/mol
LogP2.52
Rot. Bonds4

About 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide

4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide (PubChem CID 121496273) has the molecular formula C16H19N3O2S2 and a molecular weight of 349.48 g/mol. Its IUPAC name is 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
PubChem CID121496273
Molecular FormulaC16H19N3O2S2
Molecular Weight349.48 g/mol
Exact Mass349.09
IUPAC Name4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
SMILESO=C(NCCc1cccs1)N1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C16H19N3O2S2/c20-15(14-4-2-12-23-14)18-7-9-19(10-8-18)16(21)17-6-5-13-3-1-11-22-13/h1-4,11-12H,5-10H2,(H,17,21)
InChIKeyZQTHJMSWUCQSDO-UHFFFAOYSA-N
XLogP2.52
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide 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

4-(furan-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
CID 3830233
3-[4-(2-thiophen-2-ylethylcarbamoyl)piperazin-1-yl]propanoic acid
CID 61190024
4-(2-oxo-2-piperidin-1-ylethyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
CID 86912732
N-methyl-4-(thiophene-2-carbonyl)piperazine-1-carboxamide
CID 47127631
(4R)-4-hydroxy-3,3,4-trimethyl-N-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 133110763
(4-methylpiperazin-1-yl)-thiophen-2-ylmethanone;propane
CID 142296627
4-(3-cyano-2-pyridinyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
CID 86915013
N-phenyl-4-(thiophene-2-carbonyl)piperazine-1-carboxamide
CID 51186037
N-methyl-4-(thiophene-2-carbonyl)-1,4-diazepane-1-carboxamide
CID 97212820
1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone
CID 60635968
4-[2-oxo-2-(2-phenylethylamino)ethyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide
CID 4521959
N-(pyridin-3-ylmethyl)-4-(thiophene-2-carbonyl)piperazine-1-carboxamide
CID 84528908

Frequently Asked Questions

What is the IUPAC name of 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide?
The IUPAC name of 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide (CID 121496273) is 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide is O=C(NCCc1cccs1)N1CCN(C(=O)c2cccs2)CC1.
What is the InChIKey of 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide?
The InChIKey is ZQTHJMSWUCQSDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2S2/c20-15(14-4-2-12-23-14)18-7-9-19(10-8-18)16(21)17-6-5-13-3-1-11-22-13/h1-4,11-12H,5-10H2,(H,17,21).
What are the key properties of 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide?
4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide has a molecular weight of 349.48 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(thiophene-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide is sourced from PubChem (CID 121496273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).