1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine

C11H12BrNOS — CID 107960898

IUPAC1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
SMILESCNC(c1csc(Br)c1)c1ccc(C)o1
InChIInChI=1S/C11H12BrNOS/c1-7-3-4-9(14-7)11(13-2)8-5-10(12)15-6-8/h3-6,11,13H,1-2H3
InChIKeyLHWCNHGDWGXDPA-UHFFFAOYSA-N
MW286.19 g/mol
LogP3.72
Rot. Bonds3

About 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine

1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine (PubChem CID 107960898) has the molecular formula C11H12BrNOS and a molecular weight of 286.19 g/mol. Its IUPAC name is 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine.

Molecular Properties

Compound Name1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
PubChem CID107960898
Molecular FormulaC11H12BrNOS
Molecular Weight286.19 g/mol
Exact Mass284.98
IUPAC Name1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
SMILESCNC(c1csc(Br)c1)c1ccc(C)o1
InChIInChI=1S/C11H12BrNOS/c1-7-3-4-9(14-7)11(13-2)8-5-10(12)15-6-8/h3-6,11,13H,1-2H3
InChIKeyLHWCNHGDWGXDPA-UHFFFAOYSA-N
XLogP3.72
TPSA25.17 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 ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-bromofuran-2-yl)-1-(5-bromothiophen-3-yl)-N-methylmethanamine
CID 107961154
1-(5-bromothiophen-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 107960959
1-(5-bromothiophen-3-yl)-1-(2,5-dimethylfuran-3-yl)-N-methylmethanamine
CID 107960902
1-(5-bromothiophen-3-yl)-1-(4-fluoro-3,5-dimethylphenyl)-N-methylmethanamine
CID 107961080
N-methyl-1-(5-methylfuran-2-yl)-1-phenylmethanamine
CID 43481483
1-(5-bromothiophen-3-yl)-N-methyl-1-(2-methylphenyl)methanamine
CID 105094830
1-(5-bromothiophen-3-yl)-1-(4-chlorophenyl)-N-methylmethanamine
CID 105076520
1-(3,5-dimethylthiophen-2-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
CID 81155754
N-[(5-methylfuran-2-yl)-(5-methylthiophen-3-yl)methyl]ethanamine
CID 104991414
N-methyl-1-(5-methylfuran-2-yl)-1-thiophen-2-ylmethanamine
CID 43483383
1-(5-bromothiophen-3-yl)-1-(3,4-dichlorophenyl)-N-methylmethanamine
CID 105077014
1-(5-bromothiophen-3-yl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 105144257

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine?
The IUPAC name of 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine (CID 107960898) is 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine.
What is the SMILES notation for 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine?
The canonical SMILES for 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine is CNC(c1csc(Br)c1)c1ccc(C)o1.
What is the InChIKey of 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine?
The InChIKey is LHWCNHGDWGXDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrNOS/c1-7-3-4-9(14-7)11(13-2)8-5-10(12)15-6-8/h3-6,11,13H,1-2H3.
What are the key properties of 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine?
1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine has a molecular weight of 286.19 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromothiophen-3-yl)-N-methyl-1-(5-methylfuran-2-yl)methanamine is sourced from PubChem (CID 107960898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).