[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate

C18H16FNO6 — CID 8914732

IUPAC[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate
SMILESCOc1ccccc1C(=O)NC(=O)COC(=O)COc1cccc(F)c1
InChIInChI=1S/C18H16FNO6/c1-24-15-8-3-2-7-14(15)18(23)20-16(21)10-26-17(22)11-25-13-6-4-5-12(19)9-13/h2-9H,10-11H2,1H3,(H,20,21,23)
InChIKeyVOEDNWABINZTQM-UHFFFAOYSA-N
MW361.33 g/mol
LogP1.71
Rot. Bonds7

About [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate

[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate (PubChem CID 8914732) has the molecular formula C18H16FNO6 and a molecular weight of 361.33 g/mol. Its IUPAC name is [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate.

Molecular Properties

Compound Name[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate
PubChem CID8914732
Molecular FormulaC18H16FNO6
Molecular Weight361.33 g/mol
Exact Mass361.10
IUPAC Name[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate
SMILESCOc1ccccc1C(=O)NC(=O)COC(=O)COc1cccc(F)c1
InChIInChI=1S/C18H16FNO6/c1-24-15-8-3-2-7-14(15)18(23)20-16(21)10-26-17(22)11-25-13-6-4-5-12(19)9-13/h2-9H,10-11H2,1H3,(H,20,21,23)
InChIKeyVOEDNWABINZTQM-UHFFFAOYSA-N
XLogP1.71
TPSA90.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.33
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-ethoxyphenoxy)acetate
CID 39415072
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(4-propan-2-ylphenoxy)acetate
CID 8598188
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2,5-dimethylphenoxy)acetate
CID 8918280
[2-[(4-tert-butylbenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 8915149
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
CID 7791148
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-chloro-5-methylphenoxy)acetate
CID 7570439
[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 8914767
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2,6-difluorobenzoate
CID 2515349
(2-anilino-2-oxoethyl) 2-(3-fluorophenoxy)acetate
CID 8915415
[2-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 23964696
2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide
CID 2709557
[2-(2,3-dimethylanilino)-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 8915200

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate?
The IUPAC name of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate (CID 8914732) is [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate.
What is the SMILES notation for [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate?
The canonical SMILES for [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate is COc1ccccc1C(=O)NC(=O)COC(=O)COc1cccc(F)c1.
What is the InChIKey of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate?
The InChIKey is VOEDNWABINZTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO6/c1-24-15-8-3-2-7-14(15)18(23)20-16(21)10-26-17(22)11-25-13-6-4-5-12(19)9-13/h2-9H,10-11H2,1H3,(H,20,21,23).
What are the key properties of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate?
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate has a molecular weight of 361.33 g/mol, XLogP of 1.71, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate is sourced from PubChem (CID 8914732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).