[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate

C21H23NO7 — CID 7791148

IUPAC[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
SMILESCCCOc1ccccc1OCC(=O)OCC(=O)NC(=O)c1ccccc1OC
InChIInChI=1S/C21H23NO7/c1-3-12-27-17-10-6-7-11-18(17)28-14-20(24)29-13-19(23)22-21(25)15-8-4-5-9-16(15)26-2/h4-11H,3,12-14H2,1-2H3,(H,22,23,25)
InChIKeyMMSZBAGDQCVACM-UHFFFAOYSA-N
MW401.42 g/mol
LogP2.36
Rot. Bonds10

About [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate

[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate (PubChem CID 7791148) has the molecular formula C21H23NO7 and a molecular weight of 401.42 g/mol. Its IUPAC name is [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate.

Molecular Properties

Compound Name[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
PubChem CID7791148
Molecular FormulaC21H23NO7
Molecular Weight401.42 g/mol
Exact Mass401.15
IUPAC Name[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
SMILESCCCOc1ccccc1OCC(=O)OCC(=O)NC(=O)c1ccccc1OC
InChIInChI=1S/C21H23NO7/c1-3-12-27-17-10-6-7-11-18(17)28-14-20(24)29-13-19(23)22-21(25)15-8-4-5-9-16(15)26-2/h4-11H,3,12-14H2,1-2H3,(H,22,23,25)
InChIKeyMMSZBAGDQCVACM-UHFFFAOYSA-N
XLogP2.36
TPSA100.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.42
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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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-(2,5-dimethylphenoxy)acetate
CID 8918280
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-chloro-5-methylphenoxy)acetate
CID 7570439
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(4-propan-2-ylphenoxy)acetate
CID 8598188
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(3-fluorophenoxy)acetate
CID 8914732
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 3,4-diethoxybenzoate
CID 2561837
[2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethyl] 2-(2-methoxyphenoxy)acetate
CID 7854029
[2-(cyclopentylamino)-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
CID 7791219
N'-[2-(2-ethoxyphenoxy)acetyl]-2-methoxybenzohydrazide
CID 18159247
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate
CID 7951282
[2-(3,5-dimethylanilino)-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
CID 7791207

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate?
The IUPAC name of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate (CID 7791148) is [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate.
What is the SMILES notation for [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate?
The canonical SMILES for [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate is CCCOc1ccccc1OCC(=O)OCC(=O)NC(=O)c1ccccc1OC.
What is the InChIKey of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate?
The InChIKey is MMSZBAGDQCVACM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO7/c1-3-12-27-17-10-6-7-11-18(17)28-14-20(24)29-13-19(23)22-21(25)15-8-4-5-9-16(15)26-2/h4-11H,3,12-14H2,1-2H3,(H,22,23,25).
What are the key properties of [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate?
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate has a molecular weight of 401.42 g/mol, XLogP of 2.36, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 2-(2-propoxyphenoxy)acetate is sourced from PubChem (CID 7791148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).