(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine

C11H9BrFNS — CID 171203659

IUPAC(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine
SMILESN[C@H](c1ccsc1)c1c(F)cccc1Br
InChIInChI=1S/C11H9BrFNS/c12-8-2-1-3-9(13)10(8)11(14)7-4-5-15-6-7/h1-6,11H,14H2/t11-/m1/s1
InChIKeyIUSLSSSUHSSQSQ-LLVKDONJSA-N
MW286.17 g/mol
LogP3.70
Rot. Bonds2

About (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine

(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine (PubChem CID 171203659) has the molecular formula C11H9BrFNS and a molecular weight of 286.17 g/mol. Its IUPAC name is (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine
PubChem CID171203659
Molecular FormulaC11H9BrFNS
Molecular Weight286.17 g/mol
Exact Mass284.96
IUPAC Name(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine
SMILESN[C@H](c1ccsc1)c1c(F)cccc1Br
InChIInChI=1S/C11H9BrFNS/c12-8-2-1-3-9(13)10(8)11(14)7-4-5-15-6-7/h1-6,11H,14H2/t11-/m1/s1
InChIKeyIUSLSSSUHSSQSQ-LLVKDONJSA-N
XLogP3.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2-bromo-6-fluorophenyl)-thiophen-3-ylmethyl]hydrazine
CID 105280312
(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol
CID 114885783
(2-bromo-6-fluorophenyl)-(2,6-difluorophenyl)methanamine
CID 114886783
(S)-(3-bromo-2-fluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171203703
(R)-thiophen-3-yl-(2,3,6-trifluorophenyl)methanamine
CID 171224684
(S)-(2-fluoro-6-methoxyphenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171210655
(2-bromo-6-fluorophenyl)-(3,5-difluorophenyl)methanamine
CID 114886872
(2-bromo-6-fluorophenyl)-(3-bromo-4-fluorophenyl)methanamine
CID 114559070
(2-fluorophenyl)-thiophen-3-ylmethanamine
CID 62502632
(S)-(2,3,5,6-tetrafluorophenyl)-thiophen-3-ylmethanamine
CID 171210488
(R)-(2-bromo-6-fluorophenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171223227
(S)-(2,3,4,5,6-pentafluorophenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171210314

Frequently Asked Questions

What is the IUPAC name of (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine?
The IUPAC name of (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine (CID 171203659) is (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine.
What is the SMILES notation for (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine?
The canonical SMILES for (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine is N[C@H](c1ccsc1)c1c(F)cccc1Br.
What is the InChIKey of (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine?
The InChIKey is IUSLSSSUHSSQSQ-LLVKDONJSA-N. The full InChI is InChI=1S/C11H9BrFNS/c12-8-2-1-3-9(13)10(8)11(14)7-4-5-15-6-7/h1-6,11H,14H2/t11-/m1/s1.
What are the key properties of (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine?
(R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine has a molecular weight of 286.17 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanamine is sourced from PubChem (CID 171203659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).