(E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide

C15H13NO2 — CID 42632368

IUPAC(E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide
SMILESO=C(/C=C/c1ccc(-c2ccccc2)cc1)NO
InChIInChI=1S/C15H13NO2/c17-15(16-18)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-11,18H,(H,16,17)/b11-8+
InChIKeyYMXJQEHWXZULBO-DHZHZOJOSA-N
MW239.27 g/mol
LogP2.87
Rot. Bonds3

About (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide

(E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide (PubChem CID 42632368) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide
PubChem CID42632368
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name(E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide
SMILESO=C(/C=C/c1ccc(-c2ccccc2)cc1)NO
InChIInChI=1S/C15H13NO2/c17-15(16-18)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-11,18H,(H,16,17)/b11-8+
InChIKeyYMXJQEHWXZULBO-DHZHZOJOSA-N
XLogP2.87
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_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 (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide?
The IUPAC name of (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide (CID 42632368) is (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide.
What is the SMILES notation for (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide?
The canonical SMILES for (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide is O=C(/C=C/c1ccc(-c2ccccc2)cc1)NO.
What is the InChIKey of (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide?
The InChIKey is YMXJQEHWXZULBO-DHZHZOJOSA-N. The full InChI is InChI=1S/C15H13NO2/c17-15(16-18)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-11,18H,(H,16,17)/b11-8+.
What are the key properties of (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide?
(E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide has a molecular weight of 239.27 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-hydroxy-3-(4-phenylphenyl)prop-2-enamide is sourced from PubChem (CID 42632368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).