1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine

C16H14FNO — CID 114731957

IUPAC1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
SMILESCNCc1cccc(-c2cc3cccc(F)c3o2)c1
InChIInChI=1S/C16H14FNO/c1-18-10-11-4-2-5-12(8-11)15-9-13-6-3-7-14(17)16(13)19-15/h2-9,18H,10H2,1H3
InChIKeyWILUANDIOFEWQZ-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.96
Rot. Bonds3

About 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine

1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine (PubChem CID 114731957) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
PubChem CID114731957
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
SMILESCNCc1cccc(-c2cc3cccc(F)c3o2)c1
InChIInChI=1S/C16H14FNO/c1-18-10-11-4-2-5-12(8-11)15-9-13-6-3-7-14(17)16(13)19-15/h2-9,18H,10H2,1H3
InChIKeyWILUANDIOFEWQZ-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

Analyze 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
CID 114731986
1-(7-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
CID 65440139
N-[[4-(7-fluoro-1-benzofuran-2-yl)phenyl]methyl]ethanamine
CID 114732508
N-[[2-fluoro-4-(7-fluoro-1-benzofuran-2-yl)phenyl]methyl]ethanamine
CID 114732476
[4-(7-fluoro-1-benzofuran-2-yl)phenyl]methanamine
CID 114731985
1-[3-(7-chloro-1-benzofuran-2-yl)-4-fluorophenyl]-N-methylmethanamine
CID 114732546
N-methyl-1-[3-(3,4,5-trifluorophenyl)phenyl]methanamine
CID 61239496
1-[4-(7-chloro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
CID 114732026
N-[[3-fluoro-4-(7-fluoro-1-benzofuran-2-yl)phenyl]methyl]ethanamine
CID 114732481
N-[[5-(7-fluoro-1-benzofuran-2-yl)furan-2-yl]methyl]propan-2-amine
CID 106888190
ethane;2-[4-(methylaminomethyl)phenyl]-1-benzofuran-7-carboxamide
CID 156861554
ethane;1-[4-(5-fluoro-7-methyl-1-benzofuran-2-yl)phenyl]-N-methylmethanamine
CID 156861552

Frequently Asked Questions

What is the IUPAC name of 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine (CID 114731957) is 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine is CNCc1cccc(-c2cc3cccc(F)c3o2)c1.
What is the InChIKey of 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
The InChIKey is WILUANDIOFEWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-18-10-11-4-2-5-12(8-11)15-9-13-6-3-7-14(17)16(13)19-15/h2-9,18H,10H2,1H3.
What are the key properties of 1-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine?
1-[3-(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-[3-(7-fluoro-1-benzofuran-2-yl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 114731957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).