2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one

C16H18FNO2 — CID 118407952

IUPAC2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one
SMILESCCc1c(OCc2ccccc2)c(=O)ccn1CCF
InChIInChI=1S/C16H18FNO2/c1-2-14-16(15(19)8-10-18(14)11-9-17)20-12-13-6-4-3-5-7-13/h3-8,10H,2,9,11-12H2,1H3
InChIKeyDOZDIFZDJZUATC-UHFFFAOYSA-N
MW275.32 g/mol
LogP2.96
Rot. Bonds6

About 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one

2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one (PubChem CID 118407952) has the molecular formula C16H18FNO2 and a molecular weight of 275.32 g/mol. Its IUPAC name is 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one.

Molecular Properties

Compound Name2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one
PubChem CID118407952
Molecular FormulaC16H18FNO2
Molecular Weight275.32 g/mol
Exact Mass275.13
IUPAC Name2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one
SMILESCCc1c(OCc2ccccc2)c(=O)ccn1CCF
InChIInChI=1S/C16H18FNO2/c1-2-14-16(15(19)8-10-18(14)11-9-17)20-12-13-6-4-3-5-7-13/h3-8,10H,2,9,11-12H2,1H3
InChIKeyDOZDIFZDJZUATC-UHFFFAOYSA-N
XLogP2.96
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.32
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one 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

2-ethyl-1-(2-fluoroethyl)-3-hydroxypyridin-4-one
CID 118534403
3-butoxy-2-ethyl-1-(2-hydroxyethyl)pyridin-4-one
CID 90068928
1-(2-hydroxyethyl)-2-methyl-3-phenylmethoxypyridin-4-one;3-hydroxy-1-(2-hydroxyethyl)-2-methylpyridin-4-one
CID 158779776
2-[bis[1-(hydroxyamino)-3-[1-(2-hydroxyethyl)-4-oxo-3-phenylmethoxy-2-pyridinyl]-1-oxopropan-2-yl]amino]-N-hydroxy-3-[1-(2-hydroxyethyl)-4-oxo-3-phenylmethoxy-2-pyridinyl]propanamide
CID 87525030
1-(2-hydroxyethyl)-4-oxo-3-phenylmethoxy-N-propylpyridine-2-carboxamide
CID 143761971
1-[(2S)-2-hydroxy-2-phenylethyl]-2-methyl-3-phenylmethoxypyridin-4-one
CID 170560126
1-[5-(benzylamino)pentyl]-2-methyl-3-phenylmethoxypyridin-4-one
CID 162669599
3-[(1,2-diethyl-4-oxo-3-pyridinyl)oxy]propanoic acid
CID 10243320
1-butyl-2-(hydroxymethyl)-6-methyl-3-phenylmethoxypyridin-4-one
CID 156776485
1-[1-(2-methoxyethyl)-4-oxo-3-phenylmethoxy-2-pyridinyl]propylcarbamic acid
CID 87289982
4-oxo-3-phenylmethoxy-1-prop-2-enylpyridine-2-carboxylic acid
CID 58489013
2-butyl-1,6-dimethyl-3-phenylmethoxypyridin-4-one
CID 10913107

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one?
The IUPAC name of 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one (CID 118407952) is 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one.
What is the SMILES notation for 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one?
The canonical SMILES for 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one is CCc1c(OCc2ccccc2)c(=O)ccn1CCF.
What is the InChIKey of 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one?
The InChIKey is DOZDIFZDJZUATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO2/c1-2-14-16(15(19)8-10-18(14)11-9-17)20-12-13-6-4-3-5-7-13/h3-8,10H,2,9,11-12H2,1H3.
What are the key properties of 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one?
2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one has a molecular weight of 275.32 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(2-fluoroethyl)-3-phenylmethoxypyridin-4-one is sourced from PubChem (CID 118407952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).