N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide

C16H19N3O2S2 — CID 753067

IUPACN-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide
SMILESO=C(NCCN1CCN(C(=O)c2cccs2)CC1)c1cccs1
InChIInChI=1S/C16H19N3O2S2/c20-15(13-3-1-11-22-13)17-5-6-18-7-9-19(10-8-18)16(21)14-4-2-12-23-14/h1-4,11-12H,5-10H2,(H,17,20)
InChIKeyBOXSLRBGWLCOMK-UHFFFAOYSA-N
MW349.48 g/mol
LogP2.00
Rot. Bonds5

About N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide

N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide (PubChem CID 753067) has the molecular formula C16H19N3O2S2 and a molecular weight of 349.48 g/mol. Its IUPAC name is N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide
PubChem CID753067
Molecular FormulaC16H19N3O2S2
Molecular Weight349.48 g/mol
Exact Mass349.09
IUPAC NameN-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide
SMILESO=C(NCCN1CCN(C(=O)c2cccs2)CC1)c1cccs1
InChIInChI=1S/C16H19N3O2S2/c20-15(13-3-1-11-22-13)17-5-6-18-7-9-19(10-8-18)16(21)14-4-2-12-23-14/h1-4,11-12H,5-10H2,(H,17,20)
InChIKeyBOXSLRBGWLCOMK-UHFFFAOYSA-N
XLogP2.00
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-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

tert-butyl 4-{[(2-thienylcarbonyl)amino]methyl}tetrahydro-1(2H)-pyridinecarboxylate
CID 2810469
N-(1-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 1245731
N-(1,1-dioxidotetrahydrothiophen-3-yl)thiophene-2-carboxamide
CID 2891912
N1-methyl-N4-[5-(thien-2-yl)-thien-2-oyl)piperazine
CID 2814290
N-(1-Methyl-2-(1-piperidinyl)ethyl)-2-thiophenecarboxamide
CID 2971109
5-methyl-N-(1-pyrrolidin-1-yl-1-thiophen-2-ylpropan-2-yl)thiophene-2-carboxamide
CID 3573521
Thiophen-2-yl-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone
CID 4779966
N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 25162372
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]thiophene-2-carboxamide
CID 40233426
(4-Ethylsulfonylpiperazin-1-yl)-thiophen-2-ylmethanone
CID 770531
1-(1-Piperidinylsulfonyl)-4-(2-thienylcarbonyl)piperazine
CID 1258912
N-{4-[(2-thienylcarbonyl)amino]butyl}-2-thiophenecarboxamide
CID 1752547

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide (CID 753067) is N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide is O=C(NCCN1CCN(C(=O)c2cccs2)CC1)c1cccs1.
What is the InChIKey of N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide?
The InChIKey is BOXSLRBGWLCOMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2S2/c20-15(13-3-1-11-22-13)17-5-6-18-7-9-19(10-8-18)16(21)14-4-2-12-23-14/h1-4,11-12H,5-10H2,(H,17,20).
What are the key properties of N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide?
N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide has a molecular weight of 349.48 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 753067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).