N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide

C17H16FNO3 — CID 110661711

IUPACN-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NCC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H16FNO3/c1-12-4-2-3-5-16(12)22-11-17(21)19-10-15(20)13-6-8-14(18)9-7-13/h2-9H,10-11H2,1H3,(H,19,21)
InChIKeyUWVYSWHQKICRDQ-UHFFFAOYSA-N
MW301.32 g/mol
LogP2.51
Rot. Bonds6

About N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide

N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide (PubChem CID 110661711) has the molecular formula C17H16FNO3 and a molecular weight of 301.32 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide
PubChem CID110661711
Molecular FormulaC17H16FNO3
Molecular Weight301.32 g/mol
Exact Mass301.11
IUPAC NameN-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NCC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H16FNO3/c1-12-4-2-3-5-16(12)22-11-17(21)19-10-15(20)13-6-8-14(18)9-7-13/h2-9H,10-11H2,1H3,(H,19,21)
InChIKeyUWVYSWHQKICRDQ-UHFFFAOYSA-N
XLogP2.51
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(3-methylphenoxy)acetamide
CID 110661712
N-[2-(4-fluorophenyl)-2-oxoethyl]-4-(2-methylphenyl)butanamide
CID 110607579
N-[2-(4-fluorophenyl)-2-oxoethyl]-2-methylbenzamide
CID 94280945
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-(2-methylphenoxy)acetamide
CID 42266086
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 18113601
2-(2,3-dimethylphenoxy)-1-(4-fluorophenyl)ethanone
CID 2179596
N-(2-bromophenyl)-2-[[2-(2-methylphenoxy)acetyl]amino]acetamide
CID 8503107
N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide
CID 83032241
[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 9335908
1-(4-iodophenyl)-2-(2-methylphenoxy)ethanone
CID 43218793
2-(2-methylphenoxy)-N-pentylacetamide
CID 110756249
2-(2-methylphenoxy)-1-[4-(trifluoromethyl)phenyl]ethanone
CID 139247581

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide (CID 110661711) is N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)NCC(=O)c1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide?
The InChIKey is UWVYSWHQKICRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO3/c1-12-4-2-3-5-16(12)22-11-17(21)19-10-15(20)13-6-8-14(18)9-7-13/h2-9H,10-11H2,1H3,(H,19,21).
What are the key properties of N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide?
N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide has a molecular weight of 301.32 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)-2-oxoethyl]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 110661711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).