N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride

C14H24ClN3OS — CID 119390755

IUPACN-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccsc1)NCCCN1CCNCC1
InChIInChI=1S/C14H23N3OS.ClH/c18-14(3-2-13-4-11-19-12-13)16-5-1-8-17-9-6-15-7-10-17;/h4,11-12,15H,1-3,5-10H2,(H,16,18);1H
InChIKeyDEYUBQZKVYIESH-UHFFFAOYSA-N
MW317.89 g/mol
LogP1.51
Rot. Bonds7

About N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride

N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride (PubChem CID 119390755) has the molecular formula C14H24ClN3OS and a molecular weight of 317.89 g/mol. Its IUPAC name is N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride
PubChem CID119390755
Molecular FormulaC14H24ClN3OS
Molecular Weight317.89 g/mol
Exact Mass317.13
IUPAC NameN-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccsc1)NCCCN1CCNCC1
InChIInChI=1S/C14H23N3OS.ClH/c18-14(3-2-13-4-11-19-12-13)16-5-1-8-17-9-6-15-7-10-17;/h4,11-12,15H,1-3,5-10H2,(H,16,18);1H
InChIKeyDEYUBQZKVYIESH-UHFFFAOYSA-N
XLogP1.51
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.89
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride 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-[3-(4-hydroxypiperidin-1-yl)propyl]-3-thiophen-3-ylpropanamide
CID 111429543
N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-3-thiophen-3-ylpropanamide
CID 39540383
3-[4-(methylsulfamoyl)phenyl]-N-(3-piperazin-1-ylpropyl)propanamide;hydrochloride
CID 119393763
N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-thiophen-3-ylpropanamide
CID 38440769
N-[4-oxo-4-(2-piperazin-1-ylethylamino)butyl]thiophene-3-carboxamide
CID 119446128
N-[2-(4-methylpiperidin-1-yl)ethyl]-3-thiophen-3-ylpropanamide
CID 47036203
3-(3-methoxyphenyl)-N-(3-piperazin-1-ylpropyl)propanamide;hydrochloride
CID 119393865
N-(3-piperazin-1-ylpropyl)-4-thiophen-2-ylbutanamide
CID 43443283
N-[3-oxo-3-(3-piperazin-1-ylpropylamino)propyl]thiophene-2-carboxamide;hydrochloride
CID 119393805
3-(2,4-dimethylphenyl)-N-(3-piperazin-1-ylpropyl)propanamide;hydrochloride
CID 119391223
4-(5-bromothiophen-2-yl)-N-(3-piperazin-1-ylpropyl)butanamide;hydrochloride
CID 119394190
4-oxo-4-phenyl-N-(3-piperazin-1-ylpropyl)butanamide;hydrochloride
CID 119394229

Frequently Asked Questions

What is the IUPAC name of N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride?
The IUPAC name of N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride (CID 119390755) is N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride.
What is the SMILES notation for N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride?
The canonical SMILES for N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride is Cl.O=C(CCc1ccsc1)NCCCN1CCNCC1.
What is the InChIKey of N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride?
The InChIKey is DEYUBQZKVYIESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3OS.ClH/c18-14(3-2-13-4-11-19-12-13)16-5-1-8-17-9-6-15-7-10-17;/h4,11-12,15H,1-3,5-10H2,(H,16,18);1H.
What are the key properties of N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride?
N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride has a molecular weight of 317.89 g/mol, XLogP of 1.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-piperazin-1-ylpropyl)-3-thiophen-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119390755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).