1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine

C10H10FNO — CID 65440139

IUPAC1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
SMILESCNCc1cc2cccc(F)c2o1
InChIInChI=1S/C10H10FNO/c1-12-6-8-5-7-3-2-4-9(11)10(7)13-8/h2-5,12H,6H2,1H3
InChIKeySQOHNYQKKORHHC-UHFFFAOYSA-N
MW179.19 g/mol
LogP2.29
Rot. Bonds2

About 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine

1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine (PubChem CID 65440139) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
PubChem CID65440139
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
SMILESCNCc1cc2cccc(F)c2o1
InChIInChI=1S/C10H10FNO/c1-12-6-8-5-7-3-2-4-9(11)10(7)13-8/h2-5,12H,6H2,1H3
InChIKeySQOHNYQKKORHHC-UHFFFAOYSA-N
XLogP2.29
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine (CID 65440139) is 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine is CNCc1cc2cccc(F)c2o1.
What is the InChIKey of 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine?
The InChIKey is SQOHNYQKKORHHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO/c1-12-6-8-5-7-3-2-4-9(11)10(7)13-8/h2-5,12H,6H2,1H3.
What are the key properties of 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine?
1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine has a molecular weight of 179.19 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine is sourced from PubChem (CID 65440139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).