2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide

C19H20FNO4 — CID 18077065

IUPAC2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
SMILESCOc1ccc(OCC(=O)NCCc2ccc(F)cc2)c(C(C)=O)c1
InChIInChI=1S/C19H20FNO4/c1-13(22)17-11-16(24-2)7-8-18(17)25-12-19(23)21-10-9-14-3-5-15(20)6-4-14/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)
InChIKeyQLLXGTITZKMPEI-UHFFFAOYSA-N
MW345.37 g/mol
LogP2.77
Rot. Bonds8

About 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide

2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide (PubChem CID 18077065) has the molecular formula C19H20FNO4 and a molecular weight of 345.37 g/mol. Its IUPAC name is 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
PubChem CID18077065
Molecular FormulaC19H20FNO4
Molecular Weight345.37 g/mol
Exact Mass345.14
IUPAC Name2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
SMILESCOc1ccc(OCC(=O)NCCc2ccc(F)cc2)c(C(C)=O)c1
InChIInChI=1S/C19H20FNO4/c1-13(22)17-11-16(24-2)7-8-18(17)25-12-19(23)21-10-9-14-3-5-15(20)6-4-14/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)
InChIKeyQLLXGTITZKMPEI-UHFFFAOYSA-N
XLogP2.77
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.37
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]-4-methoxybenzamide
CID 18085820
2-(2-acetyl-4-chlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 7167777
2-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]-5-methoxybenzoic acid
CID 45419477
2-(2-acetyl-4-fluorophenoxy)-N-propylacetamide
CID 71628000
N-[2-(4-fluorophenyl)ethyl]-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7478784
[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 2-bromo-5-methoxybenzoate
CID 7500277
3-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 18107472
2-(2-acetyl-5-methoxyphenoxy)-N-propylacetamide
CID 40625824
[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 7846555
3-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]-N-(2-methoxyphenyl)naphthalene-2-carboxamide
CID 32512845
4-[2-(4-fluoroanilino)-2-oxoethoxy]-3-methoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 16552543
2-(2-acetamido-5-acetylphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 17457848

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide (CID 18077065) is 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide is COc1ccc(OCC(=O)NCCc2ccc(F)cc2)c(C(C)=O)c1.
What is the InChIKey of 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is QLLXGTITZKMPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO4/c1-13(22)17-11-16(24-2)7-8-18(17)25-12-19(23)21-10-9-14-3-5-15(20)6-4-14/h3-8,11H,9-10,12H2,1-2H3,(H,21,23).
What are the key properties of 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 345.37 g/mol, XLogP of 2.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-4-methoxyphenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 18077065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).