2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide

C18H18N2O5 — CID 110786884

IUPAC2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide
SMILESCOc1ccccc1OCC(=O)NCc1ccc2oc(=O)n(C)c2c1
InChIInChI=1S/C18H18N2O5/c1-20-13-9-12(7-8-14(13)25-18(20)22)10-19-17(21)11-24-16-6-4-3-5-15(16)23-2/h3-9H,10-11H2,1-2H3,(H,19,21)
InChIKeyZOVXRIPLMWBAFX-UHFFFAOYSA-N
MW342.35 g/mol
LogP1.84
Rot. Bonds6

About 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide

2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide (PubChem CID 110786884) has the molecular formula C18H18N2O5 and a molecular weight of 342.35 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide
PubChem CID110786884
Molecular FormulaC18H18N2O5
Molecular Weight342.35 g/mol
Exact Mass342.12
IUPAC Name2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide
SMILESCOc1ccccc1OCC(=O)NCc1ccc2oc(=O)n(C)c2c1
InChIInChI=1S/C18H18N2O5/c1-20-13-9-12(7-8-14(13)25-18(20)22)10-19-17(21)11-24-16-6-4-3-5-15(16)23-2/h3-9H,10-11H2,1-2H3,(H,19,21)
InChIKeyZOVXRIPLMWBAFX-UHFFFAOYSA-N
XLogP1.84
TPSA82.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide (CID 110786884) is 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide is COc1ccccc1OCC(=O)NCc1ccc2oc(=O)n(C)c2c1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide?
The InChIKey is ZOVXRIPLMWBAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O5/c1-20-13-9-12(7-8-14(13)25-18(20)22)10-19-17(21)11-24-16-6-4-3-5-15(16)23-2/h3-9H,10-11H2,1-2H3,(H,19,21).
What are the key properties of 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide?
2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide has a molecular weight of 342.35 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(3-methyl-2-oxo-1,3-benzoxazol-5-yl)methyl]acetamide is sourced from PubChem (CID 110786884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).