2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide

C15H16N2O3 — CID 5013172

IUPAC2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide
SMILESCC(=NNC(=O)C(O)c1ccccc1)c1ccc(C)o1
InChIInChI=1S/C15H16N2O3/c1-10-8-9-13(20-10)11(2)16-17-15(19)14(18)12-6-4-3-5-7-12/h3-9,14,18H,1-2H3,(H,17,19)
InChIKeyWYLZBHKKGRHUNF-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.16
Rot. Bonds4

About 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide

2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide (PubChem CID 5013172) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide
PubChem CID5013172
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide
SMILESCC(=NNC(=O)C(O)c1ccccc1)c1ccc(C)o1
InChIInChI=1S/C15H16N2O3/c1-10-8-9-13(20-10)11(2)16-17-15(19)14(18)12-6-4-3-5-7-12/h3-9,14,18H,1-2H3,(H,17,19)
InChIKeyWYLZBHKKGRHUNF-UHFFFAOYSA-N
XLogP2.16
TPSA74.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide?
The IUPAC name of 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide (CID 5013172) is 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide.
What is the SMILES notation for 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide?
The canonical SMILES for 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide is CC(=NNC(=O)C(O)c1ccccc1)c1ccc(C)o1.
What is the InChIKey of 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide?
The InChIKey is WYLZBHKKGRHUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-10-8-9-13(20-10)11(2)16-17-15(19)14(18)12-6-4-3-5-7-12/h3-9,14,18H,1-2H3,(H,17,19).
What are the key properties of 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide?
2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide has a molecular weight of 272.30 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[1-(5-methylfuran-2-yl)ethylideneamino]-2-phenylacetamide is sourced from PubChem (CID 5013172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).