1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine

C16H14FNO — CID 114731986

IUPAC1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1-c1cc2cccc(F)c2o1
InChIInChI=1S/C16H14FNO/c1-18-10-12-5-2-3-7-13(12)15-9-11-6-4-8-14(17)16(11)19-15/h2-9,18H,10H2,1H3
InChIKeyJPUFAEVRKSCXLI-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.96
Rot. Bonds3

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

1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine (PubChem CID 114731986) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
PubChem CID114731986
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1-c1cc2cccc(F)c2o1
InChIInChI=1S/C16H14FNO/c1-18-10-12-5-2-3-7-13(12)15-9-11-6-4-8-14(17)16(11)19-15/h2-9,18H,10H2,1H3
InChIKeyJPUFAEVRKSCXLI-UHFFFAOYSA-N
XLogP3.96
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
CID 114731957
1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
CID 65440139
N-ethyl-1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]ethanamine
CID 114732474
N-[[3-fluoro-4-(7-fluoro-1-benzofuran-2-yl)phenyl]methyl]ethanamine
CID 114732481
1-[3-(7-chloro-1-benzofuran-2-yl)-4-fluorophenyl]-N-methylmethanamine
CID 114732546
N-[[2-fluoro-4-(7-fluoro-1-benzofuran-2-yl)phenyl]methyl]ethanamine
CID 114732476
1-[2-(5-bromo-2-fluorophenyl)phenyl]-N-methylmethanamine
CID 79743234
N-[[4-(7-fluoro-1-benzofuran-2-yl)phenyl]methyl]ethanamine
CID 114732508
2,5-dichloro-4-(7-fluoro-1-benzofuran-2-yl)phenol
CID 107663435
N-[[5-(7-fluoro-1-benzofuran-2-yl)furan-2-yl]methyl]propan-2-amine
CID 106888190
2-(2-ethylphenyl)-7-methoxy-1-benzofuran
CID 22734156
4-(7-fluoro-1-benzofuran-2-yl)-2,3-dihydro-1H-indole
CID 114731967

Frequently Asked Questions

What is the IUPAC name of 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine (CID 114731986) is 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine is CNCc1ccccc1-c1cc2cccc(F)c2o1.
What is the InChIKey of 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
The InChIKey is JPUFAEVRKSCXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-18-10-12-5-2-3-7-13(12)15-9-11-6-4-8-14(17)16(11)19-15/h2-9,18H,10H2,1H3.
What are the key properties of 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine has a molecular weight of 255.29 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 114731986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).