(2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide

C16H16N2O3 — CID 135603975

IUPAC(2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide
SMILESC[C@@H](Oc1ccccc1)C(=O)N/N=C/c1ccc(O)cc1
InChIInChI=1S/C16H16N2O3/c1-12(21-15-5-3-2-4-6-15)16(20)18-17-11-13-7-9-14(19)10-8-13/h2-12,19H,1H3,(H,18,20)/b17-11+/t12-/m1/s1
InChIKeyHTSFWLZHGCFJMX-PBSOMRJOSA-N
MW284.32 g/mol
LogP2.31
Rot. Bonds5

About (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide

(2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide (PubChem CID 135603975) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide.

Molecular Properties

Compound Name(2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide
PubChem CID135603975
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name(2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide
SMILESC[C@@H](Oc1ccccc1)C(=O)N/N=C/c1ccc(O)cc1
InChIInChI=1S/C16H16N2O3/c1-12(21-15-5-3-2-4-6-15)16(20)18-17-11-13-7-9-14(19)10-8-13/h2-12,19H,1H3,(H,18,20)/b17-11+/t12-/m1/s1
InChIKeyHTSFWLZHGCFJMX-PBSOMRJOSA-N
XLogP2.31
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'}

Analyze (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-hydroxyphenyl)methylideneamino]-2-(4-phenylmethoxyphenoxy)propanamide
CID 4674531
N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-(3-methylphenoxy)propanamide
CID 135886344
(2R)-2-(4-bromophenoxy)-N-[(Z)-(4-hydroxyphenyl)methylideneamino]propanamide
CID 136766953
2-(4-bromophenoxy)-N-[(E)-(4-hydroxyphenyl)methylideneamino]propanamide
CID 135659445
(2S)-2-(3-bromophenoxy)-N-[(E)-(4-hydroxyphenyl)methylideneamino]propanamide
CID 135784407
(2R)-2-(3-bromophenoxy)-N-[(E)-(4-hydroxyphenyl)methylideneamino]propanamide
CID 135784413
[4-[(2-phenoxypropanoylhydrazinylidene)methyl]phenyl] benzoate
CID 4633646
N-[(4-hydroxyphenyl)methylideneamino]-2-(4-nitrophenoxy)propanamide
CID 5147897
N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-(4-nitrophenoxy)propanamide
CID 135659369
(2R)-N-[(Z)-(4-hydroxyphenyl)methylideneamino]-2-(4-nitrophenoxy)propanamide
CID 136766986
(2S)-N-[(Z)-benzylideneamino]-2-(4-chlorophenoxy)propanamide
CID 5395999
(2R)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2-phenoxypropanamide
CID 7275620

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide?
The IUPAC name of (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide (CID 135603975) is (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide.
What is the SMILES notation for (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide?
The canonical SMILES for (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide is C[C@@H](Oc1ccccc1)C(=O)N/N=C/c1ccc(O)cc1.
What is the InChIKey of (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide?
The InChIKey is HTSFWLZHGCFJMX-PBSOMRJOSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-12(21-15-5-3-2-4-6-15)16(20)18-17-11-13-7-9-14(19)10-8-13/h2-12,19H,1H3,(H,18,20)/b17-11+/t12-/m1/s1.
What are the key properties of (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide?
(2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide has a molecular weight of 284.32 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-phenoxypropanamide is sourced from PubChem (CID 135603975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).