N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C16H14N2O4 — CID 3580506

IUPACN-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2c(=O)oc3ccccc32)cc1
InChIInChI=1S/C16H14N2O4/c1-21-12-8-6-11(7-9-12)17-15(19)10-18-13-4-2-3-5-14(13)22-16(18)20/h2-9H,10H2,1H3,(H,17,19)
InChIKeyOPRFTMMGIJIXQN-UHFFFAOYSA-N
MW298.30 g/mol
LogP2.24
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 3580506) has the molecular formula C16H14N2O4 and a molecular weight of 298.30 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID3580506
Molecular FormulaC16H14N2O4
Molecular Weight298.30 g/mol
Exact Mass298.10
IUPAC NameN-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2c(=O)oc3ccccc32)cc1
InChIInChI=1S/C16H14N2O4/c1-21-12-8-6-11(7-9-12)17-15(19)10-18-13-4-2-3-5-14(13)22-16(18)20/h2-9H,10H2,1H3,(H,17,19)
InChIKeyOPRFTMMGIJIXQN-UHFFFAOYSA-N
XLogP2.24
TPSA73.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 3580506) is N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is COc1ccc(NC(=O)Cn2c(=O)oc3ccccc32)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is OPRFTMMGIJIXQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O4/c1-21-12-8-6-11(7-9-12)17-15(19)10-18-13-4-2-3-5-14(13)22-16(18)20/h2-9H,10H2,1H3,(H,17,19).
What are the key properties of N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 298.30 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 3580506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).