4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide

C14H15N3O3 — CID 110743557

IUPAC4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)NCCc2cocn2)cc1
InChIInChI=1S/C14H15N3O3/c1-10(18)17-12-4-2-11(3-5-12)14(19)15-7-6-13-8-20-9-16-13/h2-5,8-9H,6-7H2,1H3,(H,15,19)(H,17,18)
InChIKeyAAOPNAXVGXWLHU-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.61
Rot. Bonds5

About 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide

4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide (PubChem CID 110743557) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide
PubChem CID110743557
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)NCCc2cocn2)cc1
InChIInChI=1S/C14H15N3O3/c1-10(18)17-12-4-2-11(3-5-12)14(19)15-7-6-13-8-20-9-16-13/h2-5,8-9H,6-7H2,1H3,(H,15,19)(H,17,18)
InChIKeyAAOPNAXVGXWLHU-UHFFFAOYSA-N
XLogP1.61
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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4-acetamido-N-[2-(2-methoxy-4,5-dimethylphenyl)ethyl]benzamide
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Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide?
The IUPAC name of 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide (CID 110743557) is 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide.
What is the SMILES notation for 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide?
The canonical SMILES for 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide is CC(=O)Nc1ccc(C(=O)NCCc2cocn2)cc1.
What is the InChIKey of 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide?
The InChIKey is AAOPNAXVGXWLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-10(18)17-12-4-2-11(3-5-12)14(19)15-7-6-13-8-20-9-16-13/h2-5,8-9H,6-7H2,1H3,(H,15,19)(H,17,18).
What are the key properties of 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide?
4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide has a molecular weight of 273.29 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[2-(1,3-oxazol-4-yl)ethyl]benzamide is sourced from PubChem (CID 110743557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).