[2-(methoxycarbamoyl)phenyl] acetate

C10H11NO4 — CID 59130426

IUPAC[2-(methoxycarbamoyl)phenyl] acetate
SMILESCONC(=O)c1ccccc1OC(C)=O
InChIInChI=1S/C10H11NO4/c1-7(12)15-9-6-4-3-5-8(9)10(13)11-14-2/h3-6H,1-2H3,(H,11,13)
InChIKeyVCLLOAZEFCKGJT-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.90
Rot. Bonds3

About [2-(methoxycarbamoyl)phenyl] acetate

[2-(methoxycarbamoyl)phenyl] acetate (PubChem CID 59130426) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is [2-(methoxycarbamoyl)phenyl] acetate.

Molecular Properties

Compound Name[2-(methoxycarbamoyl)phenyl] acetate
PubChem CID59130426
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name[2-(methoxycarbamoyl)phenyl] acetate
SMILESCONC(=O)c1ccccc1OC(C)=O
InChIInChI=1S/C10H11NO4/c1-7(12)15-9-6-4-3-5-8(9)10(13)11-14-2/h3-6H,1-2H3,(H,11,13)
InChIKeyVCLLOAZEFCKGJT-UHFFFAOYSA-N
XLogP0.90
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}

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Related Compounds

[2-(acetylcarbamoyl)phenyl] acetate
CID 12538006
N-methoxy-2-(2-methoxyethoxy)benzamide
CID 47366431
[2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]carbamoyl]phenyl] acetate
CID 91810847
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
[2-(2-aminoacetyl)phenyl] acetate
CID 129189924
[2-[(2,2,2-trichloro-1-hydroxyethyl)carbamoyl]phenyl] acetate
CID 12922486
[2-[(4-iodophenyl)carbamoyl]phenyl] acetate
CID 3361929
potassium;2-acetyloxybenzoic acid;chloride
CID 161210106
2-acetyloxybenzoic acid;ethene
CID 67877309
(2-acetyloxybenzoyl)-sulfanylazanium
CID 173416352
calcium;2-acetyloxybenzoate;urea
CID 23618458
[2-(2-hydroxyacetyl)phenyl] acetate
CID 101117820

Frequently Asked Questions

What is the IUPAC name of [2-(methoxycarbamoyl)phenyl] acetate?
The IUPAC name of [2-(methoxycarbamoyl)phenyl] acetate (CID 59130426) is [2-(methoxycarbamoyl)phenyl] acetate.
What is the SMILES notation for [2-(methoxycarbamoyl)phenyl] acetate?
The canonical SMILES for [2-(methoxycarbamoyl)phenyl] acetate is CONC(=O)c1ccccc1OC(C)=O.
What is the InChIKey of [2-(methoxycarbamoyl)phenyl] acetate?
The InChIKey is VCLLOAZEFCKGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-7(12)15-9-6-4-3-5-8(9)10(13)11-14-2/h3-6H,1-2H3,(H,11,13).
What are the key properties of [2-(methoxycarbamoyl)phenyl] acetate?
[2-(methoxycarbamoyl)phenyl] acetate has a molecular weight of 209.20 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxycarbamoyl)phenyl] acetate is sourced from PubChem (CID 59130426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).