(5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine

C11H12BrNOS — CID 62344791

IUPAC(5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine
SMILESCCc1ccc(C(N)c2ccc(Br)s2)o1
InChIInChI=1S/C11H12BrNOS/c1-2-7-3-4-8(14-7)11(13)9-5-6-10(12)15-9/h3-6,11H,2,13H2,1H3
InChIKeyLAPCCLKXNSQOBW-UHFFFAOYSA-N
MW286.19 g/mol
LogP3.71
Rot. Bonds3

About (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine

(5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine (PubChem CID 62344791) has the molecular formula C11H12BrNOS and a molecular weight of 286.19 g/mol. Its IUPAC name is (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine.

Molecular Properties

Compound Name(5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine
PubChem CID62344791
Molecular FormulaC11H12BrNOS
Molecular Weight286.19 g/mol
Exact Mass284.98
IUPAC Name(5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine
SMILESCCc1ccc(C(N)c2ccc(Br)s2)o1
InChIInChI=1S/C11H12BrNOS/c1-2-7-3-4-8(14-7)11(13)9-5-6-10(12)15-9/h3-6,11H,2,13H2,1H3
InChIKeyLAPCCLKXNSQOBW-UHFFFAOYSA-N
XLogP3.71
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.19
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-bromo-5-chlorothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine
CID 102827978
(5-bromothiophen-2-yl)-(5-chlorofuran-2-yl)methanamine
CID 106684358
(3,5-dibromophenyl)-(5-ethylfuran-2-yl)methanamine
CID 107979824
2-(5-bromothiophen-2-yl)-1-(5-ethylfuran-2-yl)ethanol
CID 65149874
(1R)-1-(5-ethylfuran-2-yl)ethanamine
CID 55276275
(2,5-dibromophenyl)-(5-ethylfuran-2-yl)methanamine
CID 79095600
(3-bromo-4-methylphenyl)-(5-ethylfuran-2-yl)methanamine
CID 81472297
(S)-(5-ethylfuran-2-yl)-thiophen-3-ylmethanamine
CID 94398939
(2-bromo-4-fluorophenyl)-(5-ethylfuran-2-yl)methanamine
CID 62345677
(4-bromo-3-fluorophenyl)-(5-ethylfuran-2-yl)methanamine
CID 62344613
(4-bromo-3-chlorophenyl)-(5-ethylfuran-2-yl)methanamine
CID 81290852
(5-bromofuran-2-yl)-(5-methylthiophen-2-yl)methanamine
CID 43464264

Frequently Asked Questions

What is the IUPAC name of (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine?
The IUPAC name of (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine (CID 62344791) is (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine.
What is the SMILES notation for (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine?
The canonical SMILES for (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine is CCc1ccc(C(N)c2ccc(Br)s2)o1.
What is the InChIKey of (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine?
The InChIKey is LAPCCLKXNSQOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrNOS/c1-2-7-3-4-8(14-7)11(13)9-5-6-10(12)15-9/h3-6,11H,2,13H2,1H3.
What are the key properties of (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine?
(5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine has a molecular weight of 286.19 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromothiophen-2-yl)-(5-ethylfuran-2-yl)methanamine is sourced from PubChem (CID 62344791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).