N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide

C20H16N2O3 — CID 166633963

IUPACN-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide
SMILESO=C(NO)c1ccc(/C=C/c2cncc(-c3ccccc3O)c2)cc1
InChIInChI=1S/C20H16N2O3/c23-19-4-2-1-3-18(19)17-11-15(12-21-13-17)6-5-14-7-9-16(10-8-14)20(24)22-25/h1-13,23,25H,(H,22,24)/b6-5+
InChIKeyXGIYNXXHSYNSIQ-AATRIKPKSA-N
MW332.36 g/mol
LogP3.74
Rot. Bonds4

About N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide

N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide (PubChem CID 166633963) has the molecular formula C20H16N2O3 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide
PubChem CID166633963
Molecular FormulaC20H16N2O3
Molecular Weight332.36 g/mol
Exact Mass332.12
IUPAC NameN-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide
SMILESO=C(NO)c1ccc(/C=C/c2cncc(-c3ccccc3O)c2)cc1
InChIInChI=1S/C20H16N2O3/c23-19-4-2-1-3-18(19)17-11-15(12-21-13-17)6-5-14-7-9-16(10-8-14)20(24)22-25/h1-13,23,25H,(H,22,24)/b6-5+
InChIKeyXGIYNXXHSYNSIQ-AATRIKPKSA-N
XLogP3.74
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', '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 N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide?
The IUPAC name of N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide (CID 166633963) is N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide?
The canonical SMILES for N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide is O=C(NO)c1ccc(/C=C/c2cncc(-c3ccccc3O)c2)cc1.
What is the InChIKey of N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide?
The InChIKey is XGIYNXXHSYNSIQ-AATRIKPKSA-N. The full InChI is InChI=1S/C20H16N2O3/c23-19-4-2-1-3-18(19)17-11-15(12-21-13-17)6-5-14-7-9-16(10-8-14)20(24)22-25/h1-13,23,25H,(H,22,24)/b6-5+.
What are the key properties of N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide?
N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide has a molecular weight of 332.36 g/mol, XLogP of 3.74, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[(E)-2-[5-(2-hydroxyphenyl)-3-pyridinyl]ethenyl]benzamide is sourced from PubChem (CID 166633963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).