3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide

C20H16N2O3 — CID 6911430

IUPAC3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1cccc(Oc2ccccc2)c1)c1cccc(O)c1
InChIInChI=1S/C20H16N2O3/c23-17-8-5-7-16(13-17)20(24)22-21-14-15-6-4-11-19(12-15)25-18-9-2-1-3-10-18/h1-14,23H,(H,22,24)/b21-14+
InChIKeyNZNXWFXUGFQKDQ-KGENOOAVSA-N
MW332.36 g/mol
LogP3.95
Rot. Bonds5

About 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide

3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide (PubChem CID 6911430) has the molecular formula C20H16N2O3 and a molecular weight of 332.36 g/mol. Its IUPAC name is 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide
PubChem CID6911430
Molecular FormulaC20H16N2O3
Molecular Weight332.36 g/mol
Exact Mass332.12
IUPAC Name3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1cccc(Oc2ccccc2)c1)c1cccc(O)c1
InChIInChI=1S/C20H16N2O3/c23-17-8-5-7-16(13-17)20(24)22-21-14-15-6-4-11-19(12-15)25-18-9-2-1-3-10-18/h1-14,23H,(H,22,24)/b21-14+
InChIKeyNZNXWFXUGFQKDQ-KGENOOAVSA-N
XLogP3.95
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.95
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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Related Compounds

N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide
CID 6870929
N-[(E)-benzylideneamino]-3-hydroxybenzamide
CID 6869110
3-chloro-N-[(Z)-(3-phenoxyphenyl)methylideneamino]benzamide
CID 94847748
4-hydroxy-3-methoxy-N-[(3-phenoxyphenyl)methylideneamino]benzamide
CID 24818461
N-[(E)-(3,5-difluoro-4-hydroxyphenyl)methylideneamino]-3-phenoxybenzamide
CID 135923638
3,5-dinitro-N-[(3-phenoxyphenyl)methylideneamino]benzamide
CID 171135969
N-[(3-bromophenyl)methylideneamino]-3-hydroxybenzamide
CID 2695972
3-chloro-N-[(Z)-(3-hydroxyphenyl)methylideneamino]benzamide
CID 5407450
3-hydroxy-N-[(E)-[3-[(4-methylphenyl)methoxy]phenyl]methylideneamino]benzamide
CID 17126659
N-[(E)-naphthalen-1-ylmethylideneamino]-3-phenoxybenzamide
CID 71467467
2-amino-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide
CID 110337163
4-(benzenesulfonamido)-N-[(Z)-(3-phenoxyphenyl)methylideneamino]benzamide
CID 6021387

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide?
The IUPAC name of 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide (CID 6911430) is 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide.
What is the SMILES notation for 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide?
The canonical SMILES for 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide is O=C(N/N=C/c1cccc(Oc2ccccc2)c1)c1cccc(O)c1.
What is the InChIKey of 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide?
The InChIKey is NZNXWFXUGFQKDQ-KGENOOAVSA-N. The full InChI is InChI=1S/C20H16N2O3/c23-17-8-5-7-16(13-17)20(24)22-21-14-15-6-4-11-19(12-15)25-18-9-2-1-3-10-18/h1-14,23H,(H,22,24)/b21-14+.
What are the key properties of 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide?
3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide has a molecular weight of 332.36 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[(E)-(3-phenoxyphenyl)methylideneamino]benzamide is sourced from PubChem (CID 6911430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).