1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine

C11H12FNO — CID 107662176

IUPAC1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine
SMILESCc1ccc2cc(C(C)N)oc2c1F
InChIInChI=1S/C11H12FNO/c1-6-3-4-8-5-9(7(2)13)14-11(8)10(6)12/h3-5,7H,13H2,1-2H3
InChIKeyOFIUXTCTHHZPMV-UHFFFAOYSA-N
MW193.22 g/mol
LogP2.90
Rot. Bonds1

About 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine

1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine (PubChem CID 107662176) has the molecular formula C11H12FNO and a molecular weight of 193.22 g/mol. Its IUPAC name is 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine.

Molecular Properties

Compound Name1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine
PubChem CID107662176
Molecular FormulaC11H12FNO
Molecular Weight193.22 g/mol
Exact Mass193.09
IUPAC Name1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine
SMILESCc1ccc2cc(C(C)N)oc2c1F
InChIInChI=1S/C11H12FNO/c1-6-3-4-8-5-9(7(2)13)14-11(8)10(6)12/h3-5,7H,13H2,1-2H3
InChIKeyOFIUXTCTHHZPMV-UHFFFAOYSA-N
XLogP2.90
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(7-fluoro-6-methyl-1-benzofuran-2-yl)-N-methylethanamine
CID 107662182
1-(6,7-difluoro-1-benzofuran-2-yl)-2-methylpropan-1-amine
CID 65440612
2-(1-aminoethyl)-1-benzofuran-7-ol
CID 82599376
1-(7-bromo-5-fluoro-1-benzofuran-2-yl)ethanamine
CID 65440930
1-(6-chloro-7-fluoro-1-benzofuran-2-yl)ethanol
CID 116690892
1-(7-bromo-5-methyl-1-benzofuran-2-yl)ethanamine
CID 65438612
2-(1-aminoethyl)-N,N-diethyl-1-benzofuran-6-amine
CID 43122405
(1R)-1-(4,5-dimethylfuran-2-yl)ethanamine;hydrochloride
CID 171213830
1-(6,7-difluoro-1-benzofuran-2-yl)-N-ethyl-2-methylpropan-1-amine
CID 65441173
1-(6,7-dimethyl-1-benzofuran-2-yl)-N,2-dimethylpropan-1-amine
CID 65440389
(7-methyl-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanamine
CID 105045627
1-[4-fluoro-3-(7-methyl-1-benzofuran-2-yl)phenyl]ethanamine
CID 114732293

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine?
The IUPAC name of 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine (CID 107662176) is 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine.
What is the SMILES notation for 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine?
The canonical SMILES for 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine is Cc1ccc2cc(C(C)N)oc2c1F.
What is the InChIKey of 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine?
The InChIKey is OFIUXTCTHHZPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO/c1-6-3-4-8-5-9(7(2)13)14-11(8)10(6)12/h3-5,7H,13H2,1-2H3.
What are the key properties of 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine?
1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine has a molecular weight of 193.22 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-6-methyl-1-benzofuran-2-yl)ethanamine is sourced from PubChem (CID 107662176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).