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

C10H17Cl2FN2S — CID 171294136

IUPAC1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride
SMILESCl.Cl.FC[C@H](c1cccs1)N1CCNCC1
InChIInChI=1S/C10H15FN2S.2ClH/c11-8-9(10-2-1-7-14-10)13-5-3-12-4-6-13;;/h1-2,7,9,12H,3-6,8H2;2*1H/t9-;;/m1../s1
InChIKeyIVIDDRBWRVKJGL-KLQYNRQASA-N
MW287.23 g/mol
LogP2.51
Rot. Bonds3

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

1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride (PubChem CID 171294136) has the molecular formula C10H17Cl2FN2S and a molecular weight of 287.23 g/mol. Its IUPAC name is 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride.

Molecular Properties

Compound Name1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride
PubChem CID171294136
Molecular FormulaC10H17Cl2FN2S
Molecular Weight287.23 g/mol
Exact Mass286.05
IUPAC Name1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride
SMILESCl.Cl.FC[C@H](c1cccs1)N1CCNCC1
InChIInChI=1S/C10H15FN2S.2ClH/c11-8-9(10-2-1-7-14-10)13-5-3-12-4-6-13;;/h1-2,7,9,12H,3-6,8H2;2*1H/t9-;;/m1../s1
InChIKeyIVIDDRBWRVKJGL-KLQYNRQASA-N
XLogP2.51
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.23
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1R)-4,4,4-trifluoro-1-thiophen-2-ylbutyl]piperazine;dihydrochloride
CID 171303977
2-piperazin-1-yl-2-thiophen-2-ylethanamine
CID 82078137
1-[(1S)-2-cyclopropyl-1-thiophen-2-ylethyl]piperazine;dihydrochloride
CID 171281527
1-[(1R)-1-thiophen-2-ylpentyl]piperazine;dihydrochloride
CID 171308182
1-[(1R)-2-cyclopropyl-1-thiophen-2-ylethyl]piperazine
CID 171294145
1-[(1R)-4-methyl-1-thiophen-2-ylpentyl]piperazine
CID 171311169
1-[(1S)-1-thiophen-2-ylpentyl]piperazine
CID 171309479
N,N-diethyl-2-piperazin-1-yl-2-thiophen-2-ylethanamine
CID 83979379
1-[(1S)-2-fluoro-1-(5-methylthiophen-2-yl)ethyl]piperazine;dihydrochloride
CID 171275662
1-[(1R)-2-fluoro-1-phenylethyl]piperazine;dihydrochloride
CID 171282898
1-[(1S)-1-(5-chlorothiophen-2-yl)-2-fluoroethyl]piperazine
CID 131442620
piperazin-1-yl(thiophen-2-yl)methanamine
CID 116939719

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride?
The IUPAC name of 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride (CID 171294136) is 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride.
What is the SMILES notation for 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride?
The canonical SMILES for 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride is Cl.Cl.FC[C@H](c1cccs1)N1CCNCC1.
What is the InChIKey of 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride?
The InChIKey is IVIDDRBWRVKJGL-KLQYNRQASA-N. The full InChI is InChI=1S/C10H15FN2S.2ClH/c11-8-9(10-2-1-7-14-10)13-5-3-12-4-6-13;;/h1-2,7,9,12H,3-6,8H2;2*1H/t9-;;/m1../s1.
What are the key properties of 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride?
1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride has a molecular weight of 287.23 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-fluoro-1-thiophen-2-ylethyl]piperazine;dihydrochloride is sourced from PubChem (CID 171294136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).