N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide

C11H14N2O2 — CID 135720029

IUPACN-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide
SMILESCC/C(=N\NC(C)=O)c1ccc(O)cc1
InChIInChI=1S/C11H14N2O2/c1-3-11(13-12-8(2)14)9-4-6-10(15)7-5-9/h4-7,15H,3H2,1-2H3,(H,12,14)/b13-11+
InChIKeyXNZACIBWUSTJDF-ACCUITESSA-N
MW206.24 g/mol
LogP1.64
Rot. Bonds3

About N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide

N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide (PubChem CID 135720029) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide.

Molecular Properties

Compound NameN-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide
PubChem CID135720029
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC NameN-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide
SMILESCC/C(=N\NC(C)=O)c1ccc(O)cc1
InChIInChI=1S/C11H14N2O2/c1-3-11(13-12-8(2)14)9-4-6-10(15)7-5-9/h4-7,15H,3H2,1-2H3,(H,12,14)/b13-11+
InChIKeyXNZACIBWUSTJDF-ACCUITESSA-N
XLogP1.64
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-1-(4-chlorophenyl)propylideneamino]acetamide
CID 6011612
4-acetamido-N-[1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 910379
N'-[1-(4-hydroxyphenyl)propylideneamino]oxamide
CID 4645851
N,N'-bis[(E)-1-(4-hydroxyphenyl)propylideneamino]hexanediamide
CID 135721513
4-hydroxy-N-[1-(4-methylphenyl)propylideneamino]benzamide
CID 4622646
4-ethyl-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 135673772
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide
CID 136831660
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]hexanamide
CID 136716001
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]dodecanamide
CID 135704395
2-fluoro-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 135609434
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]-1H-pyrrole-2-carboxamide
CID 135771089
N-[1-(4-hydroxyphenyl)propylideneamino]thiophene-2-carboxamide
CID 951050

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide?
The IUPAC name of N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide (CID 135720029) is N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide.
What is the SMILES notation for N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide?
The canonical SMILES for N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide is CC/C(=N\NC(C)=O)c1ccc(O)cc1.
What is the InChIKey of N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide?
The InChIKey is XNZACIBWUSTJDF-ACCUITESSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-3-11(13-12-8(2)14)9-4-6-10(15)7-5-9/h4-7,15H,3H2,1-2H3,(H,12,14)/b13-11+.
What are the key properties of N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide?
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide has a molecular weight of 206.24 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(4-hydroxyphenyl)propylideneamino]acetamide is sourced from PubChem (CID 135720029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).