1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine

C15H16F2N2S — CID 171179292

IUPAC1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine
SMILESFc1cccc(F)c1[C@H](c1ccsc1)N1CCNCC1
InChIInChI=1S/C15H16F2N2S/c16-12-2-1-3-13(17)14(12)15(11-4-9-20-10-11)19-7-5-18-6-8-19/h1-4,9-10,15,18H,5-8H2/t15-/m0/s1
InChIKeyLFCZCMOKGPSOBL-HNNXBMFYSA-N
MW294.37 g/mol
LogP3.02
Rot. Bonds3

About 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine

1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine (PubChem CID 171179292) has the molecular formula C15H16F2N2S and a molecular weight of 294.37 g/mol. Its IUPAC name is 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine.

Molecular Properties

Compound Name1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine
PubChem CID171179292
Molecular FormulaC15H16F2N2S
Molecular Weight294.37 g/mol
Exact Mass294.10
IUPAC Name1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine
SMILESFc1cccc(F)c1[C@H](c1ccsc1)N1CCNCC1
InChIInChI=1S/C15H16F2N2S/c16-12-2-1-3-13(17)14(12)15(11-4-9-20-10-11)19-7-5-18-6-8-19/h1-4,9-10,15,18H,5-8H2/t15-/m0/s1
InChIKeyLFCZCMOKGPSOBL-HNNXBMFYSA-N
XLogP3.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine 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-[(R)-(2-chloro-6-fluorophenyl)-thiophen-3-ylmethyl]piperazine
CID 171175232
1-[(S)-(4-chloro-2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine
CID 171177467
1-[(S)-(2-chloro-3-fluorophenyl)-thiophen-3-ylmethyl]piperazine;hydrochloride
CID 171179125
2-fluoro-6-[(R)-piperazin-1-yl(thiophen-3-yl)methyl]phenol;hydrochloride
CID 171178386
1-[(R)-(2,6-difluoro-4-methoxyphenyl)-thiophen-3-ylmethyl]piperazine
CID 171181424
1-[(R)-(3,5-difluorophenyl)-thiophen-3-ylmethyl]piperazine
CID 171179419
1-[(R)-thiophen-2-yl(thiophen-3-yl)methyl]piperazine;dihydrochloride
CID 171280742
2-fluoro-4-[(R)-piperazin-1-yl(thiophen-3-yl)methyl]phenol;hydrochloride
CID 171178362
1-[(S)-(4-fluoro-3-methylphenyl)-thiophen-3-ylmethyl]piperazine;hydrochloride
CID 171175913
1-[(R)-[3-fluoro-4-(trifluoromethyl)phenyl]-thiophen-3-ylmethyl]piperazine
CID 171180508
1-[(S)-(6-chloro-2-fluoro-3-methylphenyl)-thiophen-3-ylmethyl]piperazine;hydrochloride
CID 171180363
1-[(R)-thiophen-3-yl-[3-(trifluoromethyl)phenyl]methyl]piperazine;hydrochloride
CID 171179883

Frequently Asked Questions

What is the IUPAC name of 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine?
The IUPAC name of 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine (CID 171179292) is 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine.
What is the SMILES notation for 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine?
The canonical SMILES for 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine is Fc1cccc(F)c1[C@H](c1ccsc1)N1CCNCC1.
What is the InChIKey of 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine?
The InChIKey is LFCZCMOKGPSOBL-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H16F2N2S/c16-12-2-1-3-13(17)14(12)15(11-4-9-20-10-11)19-7-5-18-6-8-19/h1-4,9-10,15,18H,5-8H2/t15-/m0/s1.
What are the key properties of 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine?
1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine has a molecular weight of 294.37 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(R)-(2,6-difluorophenyl)-thiophen-3-ylmethyl]piperazine is sourced from PubChem (CID 171179292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).