1-(2-thiophen-2-ylsulfanylpropyl)piperazine

C11H18N2S2 — CID 117035710

IUPAC1-(2-thiophen-2-ylsulfanylpropyl)piperazine
SMILESCC(CN1CCNCC1)Sc1cccs1
InChIInChI=1S/C11H18N2S2/c1-10(15-11-3-2-8-14-11)9-13-6-4-12-5-7-13/h2-3,8,10,12H,4-7,9H2,1H3
InChIKeyLRMZUJADJYEYHD-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.13
Rot. Bonds4

About 1-(2-thiophen-2-ylsulfanylpropyl)piperazine

1-(2-thiophen-2-ylsulfanylpropyl)piperazine (PubChem CID 117035710) has the molecular formula C11H18N2S2 and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-(2-thiophen-2-ylsulfanylpropyl)piperazine.

Molecular Properties

Compound Name1-(2-thiophen-2-ylsulfanylpropyl)piperazine
PubChem CID117035710
Molecular FormulaC11H18N2S2
Molecular Weight242.41 g/mol
Exact Mass242.09
IUPAC Name1-(2-thiophen-2-ylsulfanylpropyl)piperazine
SMILESCC(CN1CCNCC1)Sc1cccs1
InChIInChI=1S/C11H18N2S2/c1-10(15-11-3-2-8-14-11)9-13-6-4-12-5-7-13/h2-3,8,10,12H,4-7,9H2,1H3
InChIKeyLRMZUJADJYEYHD-UHFFFAOYSA-N
XLogP2.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2S)-butan-2-yl]sulfanylthiophene
CID 89122667
1-(3-thiophen-2-ylsulfanylpropyl)piperazine
CID 68783975
2-methyl-3-piperazin-1-yl-N-(thiophen-2-ylmethyl)propan-1-amine
CID 115255363
N,2-dimethyl-3-piperazin-1-yl-N-thiophen-2-ylpropanamide
CID 115189078
1-[2-(4-fluoro-3-methylphenyl)sulfanylpropyl]piperazine
CID 117035708
2-[ethyl-(2-piperazin-1-yl-1-thiophen-2-ylethyl)amino]ethanol
CID 82201748
1-(thiophen-2-ylmethyl)piperazine
CID 566208
1-[methyl(thiophen-2-ylmethyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65448493
2-[methyl-(2-piperazin-1-yl-1-thiophen-2-ylethyl)amino]acetic acid
CID 82201749
2-[1-(2-piperazin-1-yl-1-thiophen-2-ylethyl)piperidin-2-yl]ethanol
CID 82201737
N,2-dimethyl-1-(3-methylthiophen-2-yl)-3-piperazin-1-ylpropan-1-amine
CID 116960907
N-methyl-3-piperazin-1-yl-1-thiophen-2-ylpropan-1-amine
CID 116954947

Frequently Asked Questions

What is the IUPAC name of 1-(2-thiophen-2-ylsulfanylpropyl)piperazine?
The IUPAC name of 1-(2-thiophen-2-ylsulfanylpropyl)piperazine (CID 117035710) is 1-(2-thiophen-2-ylsulfanylpropyl)piperazine.
What is the SMILES notation for 1-(2-thiophen-2-ylsulfanylpropyl)piperazine?
The canonical SMILES for 1-(2-thiophen-2-ylsulfanylpropyl)piperazine is CC(CN1CCNCC1)Sc1cccs1.
What is the InChIKey of 1-(2-thiophen-2-ylsulfanylpropyl)piperazine?
The InChIKey is LRMZUJADJYEYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S2/c1-10(15-11-3-2-8-14-11)9-13-6-4-12-5-7-13/h2-3,8,10,12H,4-7,9H2,1H3.
What are the key properties of 1-(2-thiophen-2-ylsulfanylpropyl)piperazine?
1-(2-thiophen-2-ylsulfanylpropyl)piperazine has a molecular weight of 242.41 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-thiophen-2-ylsulfanylpropyl)piperazine is sourced from PubChem (CID 117035710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).