(R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine

C11H9BrClNS — CID 171223566

IUPAC(R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine
SMILESN[C@@H](c1cccs1)c1cc(Br)ccc1Cl
InChIInChI=1S/C11H9BrClNS/c12-7-3-4-9(13)8(6-7)11(14)10-2-1-5-15-10/h1-6,11H,14H2/t11-/m1/s1
InChIKeyMOJNGNUDAOKAGA-LLVKDONJSA-N
MW302.62 g/mol
LogP4.21
Rot. Bonds2

About (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine

(R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine (PubChem CID 171223566) has the molecular formula C11H9BrClNS and a molecular weight of 302.62 g/mol. Its IUPAC name is (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name(R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine
PubChem CID171223566
Molecular FormulaC11H9BrClNS
Molecular Weight302.62 g/mol
Exact Mass300.93
IUPAC Name(R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine
SMILESN[C@@H](c1cccs1)c1cc(Br)ccc1Cl
InChIInChI=1S/C11H9BrClNS/c12-7-3-4-9(13)8(6-7)11(14)10-2-1-5-15-10/h1-6,11H,14H2/t11-/m1/s1
InChIKeyMOJNGNUDAOKAGA-LLVKDONJSA-N
XLogP4.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.62
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromo-2-chlorophenyl)-(5-bromo-4-methylthiophen-2-yl)methanamine
CID 79992281
(5-bromo-2-chlorophenyl)-(2,5-dichlorophenyl)methanamine
CID 43378974
(S)-[5-bromo-2-(trifluoromethoxy)phenyl]-thiophen-2-ylmethanamine
CID 171208041
2-[(R)-amino(thiophen-2-yl)methyl]-4,6-dibromophenol
CID 131274072
(3,5-dibromophenyl)-thiophen-2-ylmethanamine
CID 107973859
(5-bromo-2-chlorophenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine
CID 43378947
(R)-(4-chloro-3-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171231501
(S)-(5-bromo-2-fluoro-3-methylphenyl)-thiophen-2-ylmethanamine;hydrochloride
CID 171204986
(S)-(3-chloro-2-fluorophenyl)-thiophen-2-ylmethanamine
CID 131296076
2-[(S)-amino(thiophen-2-yl)methyl]-4-chloroaniline
CID 171214226
(5-bromo-2-fluorophenyl)-(2,5-dichlorophenyl)methanamine
CID 43344673
(S)-(2-chloro-3-fluorophenyl)-thiophen-2-ylmethanamine
CID 171203052

Frequently Asked Questions

What is the IUPAC name of (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine?
The IUPAC name of (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine (CID 171223566) is (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine.
What is the SMILES notation for (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine?
The canonical SMILES for (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine is N[C@@H](c1cccs1)c1cc(Br)ccc1Cl.
What is the InChIKey of (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine?
The InChIKey is MOJNGNUDAOKAGA-LLVKDONJSA-N. The full InChI is InChI=1S/C11H9BrClNS/c12-7-3-4-9(13)8(6-7)11(14)10-2-1-5-15-10/h1-6,11H,14H2/t11-/m1/s1.
What are the key properties of (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine?
(R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine has a molecular weight of 302.62 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(5-bromo-2-chlorophenyl)-thiophen-2-ylmethanamine is sourced from PubChem (CID 171223566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).