1-[(1S)-1-thiophen-3-ylpropyl]piperazine

C11H18N2S — CID 131188138

IUPAC1-[(1S)-1-thiophen-3-ylpropyl]piperazine
SMILESCC[C@@H](c1ccsc1)N1CCNCC1
InChIInChI=1S/C11H18N2S/c1-2-11(10-3-8-14-9-10)13-6-4-12-5-7-13/h3,8-9,11-12H,2,4-7H2,1H3/t11-/m0/s1
InChIKeyQFGSYQTVDDVXPZ-NSHDSACASA-N
MW210.35 g/mol
LogP2.10
Rot. Bonds3

About 1-[(1S)-1-thiophen-3-ylpropyl]piperazine

1-[(1S)-1-thiophen-3-ylpropyl]piperazine (PubChem CID 131188138) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 1-[(1S)-1-thiophen-3-ylpropyl]piperazine.

Molecular Properties

Compound Name1-[(1S)-1-thiophen-3-ylpropyl]piperazine
PubChem CID131188138
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name1-[(1S)-1-thiophen-3-ylpropyl]piperazine
SMILESCC[C@@H](c1ccsc1)N1CCNCC1
InChIInChI=1S/C11H18N2S/c1-2-11(10-3-8-14-9-10)13-6-4-12-5-7-13/h3,8-9,11-12H,2,4-7H2,1H3/t11-/m0/s1
InChIKeyQFGSYQTVDDVXPZ-NSHDSACASA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-piperazin-1-yl-3-thiophen-3-ylpropanenitrile;dihydrochloride
CID 171307005
1-[(1S)-1-thiophen-3-ylethyl]piperazine;dihydrochloride
CID 171280726
1-[(1R)-1-(4-fluorophenyl)propyl]piperazine
CID 28798751
1-[(1R)-1-phenylpropyl]piperazine;dihydrochloride
CID 171295514
1-[(1R)-1-(4-methylphenyl)propyl]piperazine;dihydrochloride
CID 171294154
1-[(1R)-2,2-difluoro-1-thiophen-3-ylethyl]piperazine;dihydrochloride
CID 171280730
1-[1-(4-methoxyphenyl)propyl]piperazine
CID 3971378
1-[(1R)-1-(4-bromothiophen-2-yl)propyl]piperazine
CID 95490471
3-(1-piperazin-1-ylpropyl)phenol;dihydrochloride
CID 23080544
1-[1-(4-ethoxyphenyl)propyl]piperazine
CID 3597592
4-[(1S)-1-piperazin-1-ylpropyl]benzonitrile;dihydrochloride
CID 171272506
1-[(1S)-1-(3,4-difluorophenyl)propyl]piperazine
CID 95454803

Frequently Asked Questions

What is the IUPAC name of 1-[(1S)-1-thiophen-3-ylpropyl]piperazine?
The IUPAC name of 1-[(1S)-1-thiophen-3-ylpropyl]piperazine (CID 131188138) is 1-[(1S)-1-thiophen-3-ylpropyl]piperazine.
What is the SMILES notation for 1-[(1S)-1-thiophen-3-ylpropyl]piperazine?
The canonical SMILES for 1-[(1S)-1-thiophen-3-ylpropyl]piperazine is CC[C@@H](c1ccsc1)N1CCNCC1.
What is the InChIKey of 1-[(1S)-1-thiophen-3-ylpropyl]piperazine?
The InChIKey is QFGSYQTVDDVXPZ-NSHDSACASA-N. The full InChI is InChI=1S/C11H18N2S/c1-2-11(10-3-8-14-9-10)13-6-4-12-5-7-13/h3,8-9,11-12H,2,4-7H2,1H3/t11-/m0/s1.
What are the key properties of 1-[(1S)-1-thiophen-3-ylpropyl]piperazine?
1-[(1S)-1-thiophen-3-ylpropyl]piperazine has a molecular weight of 210.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S)-1-thiophen-3-ylpropyl]piperazine is sourced from PubChem (CID 131188138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).