1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride

C13H24Cl2N2S — CID 171308182

IUPAC1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride
SMILESCCCC[C@H](c1cccs1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C13H22N2S.2ClH/c1-2-3-5-12(13-6-4-11-16-13)15-9-7-14-8-10-15;;/h4,6,11-12,14H,2-3,5,7-10H2,1H3;2*1H/t12-;;/m1../s1
InChIKeyPVXWBCXEGWZKEO-CURYUGHLSA-N
MW311.32 g/mol
LogP3.73
Rot. Bonds5

About 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride

1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride (PubChem CID 171308182) has the molecular formula C13H24Cl2N2S and a molecular weight of 311.32 g/mol. Its IUPAC name is 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride.

Molecular Properties

Compound Name1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride
PubChem CID171308182
Molecular FormulaC13H24Cl2N2S
Molecular Weight311.32 g/mol
Exact Mass310.10
IUPAC Name1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride
SMILESCCCC[C@H](c1cccs1)N1CCNCC1.Cl.Cl
InChIInChI=1S/C13H22N2S.2ClH/c1-2-3-5-12(13-6-4-11-16-13)15-9-7-14-8-10-15;;/h4,6,11-12,14H,2-3,5,7-10H2,1H3;2*1H/t12-;;/m1../s1
InChIKeyPVXWBCXEGWZKEO-CURYUGHLSA-N
XLogP3.73
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride 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

1-[(1S)-1-thiophen-2-ylpentyl]piperazine
CID 171309479
1-[(1R)-4-methyl-1-thiophen-2-ylpentyl]piperazine
CID 171311169
1-[(1R)-4,4,4-trifluoro-1-thiophen-2-ylbutyl]piperazine;dihydrochloride
CID 171303977
1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride
CID 171294136
1-[(1R)-1-(5-chlorothiophen-2-yl)pentyl]piperazine
CID 171307470
2-piperazin-1-yl-2-thiophen-2-ylethanamine
CID 82078137
N,N-diethyl-2-piperazin-1-yl-2-thiophen-2-ylethanamine
CID 83979379
1-[(1S)-1-(2,6-difluorophenyl)pentyl]piperazine;dihydrochloride
CID 171309043
1-[(1S)-2-cyclopropyl-1-thiophen-2-ylethyl]piperazine;dihydrochloride
CID 171281527
1-[(1S)-1-(1H-pyrrol-2-yl)pentyl]piperazine
CID 171308857
1-[(1S)-1-(3-methylthiophen-2-yl)hexyl]piperazine
CID 171308967
1-[(1S)-1-(5-bromo-4-methylthiophen-2-yl)hexyl]piperazine;dihydrochloride
CID 171308980

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride?
The IUPAC name of 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride (CID 171308182) is 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride.
What is the SMILES notation for 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride?
The canonical SMILES for 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride is CCCC[C@H](c1cccs1)N1CCNCC1.Cl.Cl.
What is the InChIKey of 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride?
The InChIKey is PVXWBCXEGWZKEO-CURYUGHLSA-N. The full InChI is InChI=1S/C13H22N2S.2ClH/c1-2-3-5-12(13-6-4-11-16-13)15-9-7-14-8-10-15;;/h4,6,11-12,14H,2-3,5,7-10H2,1H3;2*1H/t12-;;/m1../s1.
What are the key properties of 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride?
1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride has a molecular weight of 311.32 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride is sourced from PubChem (CID 171308182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).