N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide

C19H18FNO3 — CID 90599093

IUPACN-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide
SMILESCOC(C)(CNC(=O)c1cc2ccccc2o1)c1ccccc1F
InChIInChI=1S/C19H18FNO3/c1-19(23-2,14-8-4-5-9-15(14)20)12-21-18(22)17-11-13-7-3-6-10-16(13)24-17/h3-11H,12H2,1-2H3,(H,21,22)
InChIKeyWWRSHHDUMCSTFP-UHFFFAOYSA-N
MW327.36 g/mol
LogP3.86
Rot. Bonds5

About N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide

N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide (PubChem CID 90599093) has the molecular formula C19H18FNO3 and a molecular weight of 327.36 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide
PubChem CID90599093
Molecular FormulaC19H18FNO3
Molecular Weight327.36 g/mol
Exact Mass327.13
IUPAC NameN-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide
SMILESCOC(C)(CNC(=O)c1cc2ccccc2o1)c1ccccc1F
InChIInChI=1S/C19H18FNO3/c1-19(23-2,14-8-4-5-9-15(14)20)12-21-18(22)17-11-13-7-3-6-10-16(13)24-17/h3-11H,12H2,1-2H3,(H,21,22)
InChIKeyWWRSHHDUMCSTFP-UHFFFAOYSA-N
XLogP3.86
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.36
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide (CID 90599093) is N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide is COC(C)(CNC(=O)c1cc2ccccc2o1)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide?
The InChIKey is WWRSHHDUMCSTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FNO3/c1-19(23-2,14-8-4-5-9-15(14)20)12-21-18(22)17-11-13-7-3-6-10-16(13)24-17/h3-11H,12H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide?
N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide has a molecular weight of 327.36 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methoxypropyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 90599093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).