3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide

C11H12FNO2 — CID 19611645

IUPAC3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide
SMILESNC(=O)CCc1ccc(F)c2c1CCO2
InChIInChI=1S/C11H12FNO2/c12-9-3-1-7(2-4-10(13)14)8-5-6-15-11(8)9/h1,3H,2,4-6H2,(H2,13,14)
InChIKeyOFGUVFZEVAITJE-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.18
Rot. Bonds3

About 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide

3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide (PubChem CID 19611645) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide.

Molecular Properties

Compound Name3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide
PubChem CID19611645
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide
SMILESNC(=O)CCc1ccc(F)c2c1CCO2
InChIInChI=1S/C11H12FNO2/c12-9-3-1-7(2-4-10(13)14)8-5-6-15-11(8)9/h1,3H,2,4-6H2,(H2,13,14)
InChIKeyOFGUVFZEVAITJE-UHFFFAOYSA-N
XLogP1.18
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide 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 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide?
The IUPAC name of 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide (CID 19611645) is 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide.
What is the SMILES notation for 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide?
The canonical SMILES for 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide is NC(=O)CCc1ccc(F)c2c1CCO2.
What is the InChIKey of 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide?
The InChIKey is OFGUVFZEVAITJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c12-9-3-1-7(2-4-10(13)14)8-5-6-15-11(8)9/h1,3H,2,4-6H2,(H2,13,14).
What are the key properties of 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide?
3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide has a molecular weight of 209.22 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-fluoro-2,3-dihydro-1-benzofuran-4-yl)propanamide is sourced from PubChem (CID 19611645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).