2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C14H17N3O2 — CID 47121660

IUPAC2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCCN(CC(=O)Nc1cc(C)on1)c1ccccc1
InChIInChI=1S/C14H17N3O2/c1-3-17(12-7-5-4-6-8-12)10-14(18)15-13-9-11(2)19-16-13/h4-9H,3,10H2,1-2H3,(H,15,16,18)
InChIKeyADUHJVXOZZYKOG-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.45
Rot. Bonds5

About 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 47121660) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID47121660
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCCN(CC(=O)Nc1cc(C)on1)c1ccccc1
InChIInChI=1S/C14H17N3O2/c1-3-17(12-7-5-4-6-8-12)10-14(18)15-13-9-11(2)19-16-13/h4-9H,3,10H2,1-2H3,(H,15,16,18)
InChIKeyADUHJVXOZZYKOG-UHFFFAOYSA-N
XLogP2.45
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 47121660) is 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is CCN(CC(=O)Nc1cc(C)on1)c1ccccc1.
What is the InChIKey of 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is ADUHJVXOZZYKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-17(12-7-5-4-6-8-12)10-14(18)15-13-9-11(2)19-16-13/h4-9H,3,10H2,1-2H3,(H,15,16,18).
What are the key properties of 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 259.31 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 47121660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).