2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone

C15H16FNO2 — CID 110488716

IUPAC2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone
SMILESO=C(Cc1coc2ccc(F)cc12)N1CCCCC1
InChIInChI=1S/C15H16FNO2/c16-12-4-5-14-13(9-12)11(10-19-14)8-15(18)17-6-2-1-3-7-17/h4-5,9-10H,1-3,6-8H2
InChIKeyJLEANAFJZXGELL-UHFFFAOYSA-N
MW261.30 g/mol
LogP3.13
Rot. Bonds2

About 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone

2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone (PubChem CID 110488716) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone
PubChem CID110488716
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone
SMILESO=C(Cc1coc2ccc(F)cc12)N1CCCCC1
InChIInChI=1S/C15H16FNO2/c16-12-4-5-14-13(9-12)11(10-19-14)8-15(18)17-6-2-1-3-7-17/h4-5,9-10H,1-3,6-8H2
InChIKeyJLEANAFJZXGELL-UHFFFAOYSA-N
XLogP3.13
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone 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-(4-aminopiperidin-1-yl)-2-(5-fluoro-1-benzofuran-3-yl)ethanone
CID 110488719
2-(5-methoxy-1-benzofuran-3-yl)-1-pyrrolidin-1-ylethanone
CID 110488784
2-(5-fluoro-1-benzofuran-3-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
CID 18860190
1-(azepan-1-yl)-2-(6-fluoro-1H-indol-3-yl)ethanone
CID 110856306
N-tert-butyl-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 110488706
3-(chloromethyl)-5-fluoro-1-benzofuran
CID 18184314
1-[(5-fluoro-1-benzofuran-3-yl)methyl]-4-methylpiperazine
CID 117174212
2-(5-methoxy-1-benzofuran-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone
CID 18860283
1-(4-benzylpiperazin-1-yl)-2-(5-bromo-1-benzofuran-3-yl)ethanone
CID 18860427
1-(4-benzylpiperazin-1-yl)-2-(5-methyl-1-benzofuran-3-yl)ethanone
CID 18860467
3-(piperidin-1-ylmethyl)-1-benzofuran-5-carboxylic acid
CID 117174366
2-(5-fluoro-1-benzofuran-3-yl)-N-(2-hydroxyethyl)-N-methylacetamide
CID 110488687

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone (CID 110488716) is 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone is O=C(Cc1coc2ccc(F)cc12)N1CCCCC1.
What is the InChIKey of 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone?
The InChIKey is JLEANAFJZXGELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c16-12-4-5-14-13(9-12)11(10-19-14)8-15(18)17-6-2-1-3-7-17/h4-5,9-10H,1-3,6-8H2.
What are the key properties of 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone?
2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone has a molecular weight of 261.30 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-1-benzofuran-3-yl)-1-piperidin-1-ylethanone is sourced from PubChem (CID 110488716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).