(R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine

C11H8BrF2NS — CID 131608140

IUPAC(R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine
SMILESN[C@@H](c1cccs1)c1c(F)cc(Br)cc1F
InChIInChI=1S/C11H8BrF2NS/c12-6-4-7(13)10(8(14)5-6)11(15)9-2-1-3-16-9/h1-5,11H,15H2/t11-/m0/s1
InChIKeyGZLHQVJYKVTBMH-NSHDSACASA-N
MW304.16 g/mol
LogP3.84
Rot. Bonds2

About (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine

(R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine (PubChem CID 131608140) has the molecular formula C11H8BrF2NS and a molecular weight of 304.16 g/mol. Its IUPAC name is (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name(R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine
PubChem CID131608140
Molecular FormulaC11H8BrF2NS
Molecular Weight304.16 g/mol
Exact Mass302.95
IUPAC Name(R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine
SMILESN[C@@H](c1cccs1)c1c(F)cc(Br)cc1F
InChIInChI=1S/C11H8BrF2NS/c12-6-4-7(13)10(8(14)5-6)11(15)9-2-1-3-16-9/h1-5,11H,15H2/t11-/m0/s1
InChIKeyGZLHQVJYKVTBMH-NSHDSACASA-N
XLogP3.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.16
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethyl]hydrazine
CID 105287644
(R)-(2-bromo-6-fluorophenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171223227
(3,5-dibromophenyl)-thiophen-2-ylmethanamine
CID 107973859
(R)-(3-bromo-5-fluorophenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171223526
2-[(R)-amino(thiophen-2-yl)methyl]-6-bromo-3,4-difluorophenol
CID 171254508
2-[(S)-amino(thiophen-2-yl)methyl]-6-bromo-3-fluorophenol
CID 131523204
(S)-(5-bromo-2-fluoro-3-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171204986
(2-chloro-6-fluorophenyl)-thiophen-2-ylmethanamine
CID 43186711
6-[(S)-amino(thiophen-2-yl)methyl]-4-bromo-2,3-difluorophenol
CID 171257937
dithiophen-2-ylmethanamine;hydroiodide
CID 175262247
1-[(S)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethyl]piperazine;dihydrochloride
CID 171291239
(2-fluorophenyl)-thiophen-2-ylmethanamine
CID 43186746

Frequently Asked Questions

What is the IUPAC name of (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine?
The IUPAC name of (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine (CID 131608140) is (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine.
What is the SMILES notation for (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine?
The canonical SMILES for (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine is N[C@@H](c1cccs1)c1c(F)cc(Br)cc1F.
What is the InChIKey of (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine?
The InChIKey is GZLHQVJYKVTBMH-NSHDSACASA-N. The full InChI is InChI=1S/C11H8BrF2NS/c12-6-4-7(13)10(8(14)5-6)11(15)9-2-1-3-16-9/h1-5,11H,15H2/t11-/m0/s1.
What are the key properties of (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine?
(R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine has a molecular weight of 304.16 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethanamine is sourced from PubChem (CID 131608140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).