(E)-3-(4-phenylphenyl)prop-2-enehydrazide

C15H14N2O — CID 122191258

IUPAC(E)-3-(4-phenylphenyl)prop-2-enehydrazide
SMILESNNC(=O)/C=C/c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H14N2O/c16-17-15(18)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-11H,16H2,(H,17,18)/b11-8+
InChIKeyDGUXGBQRBYBUOV-DHZHZOJOSA-N
MW238.29 g/mol
LogP2.36
Rot. Bonds3

About (E)-3-(4-phenylphenyl)prop-2-enehydrazide

(E)-3-(4-phenylphenyl)prop-2-enehydrazide (PubChem CID 122191258) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is (E)-3-(4-phenylphenyl)prop-2-enehydrazide.

Molecular Properties

Compound Name(E)-3-(4-phenylphenyl)prop-2-enehydrazide
PubChem CID122191258
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name(E)-3-(4-phenylphenyl)prop-2-enehydrazide
SMILESNNC(=O)/C=C/c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H14N2O/c16-17-15(18)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-11H,16H2,(H,17,18)/b11-8+
InChIKeyDGUXGBQRBYBUOV-DHZHZOJOSA-N
XLogP2.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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(E)-3-phenyl-N'-propylprop-2-enehydrazide
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(2E)-3-phenyl-N'-[(2E)-3-phenylprop-2-enoyl]prop-2-enehydrazide
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(E)-3-(3-fluorophenyl)prop-2-enehydrazide
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Frequently Asked Questions

What is the IUPAC name of (E)-3-(4-phenylphenyl)prop-2-enehydrazide?
The IUPAC name of (E)-3-(4-phenylphenyl)prop-2-enehydrazide (CID 122191258) is (E)-3-(4-phenylphenyl)prop-2-enehydrazide.
What is the SMILES notation for (E)-3-(4-phenylphenyl)prop-2-enehydrazide?
The canonical SMILES for (E)-3-(4-phenylphenyl)prop-2-enehydrazide is NNC(=O)/C=C/c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (E)-3-(4-phenylphenyl)prop-2-enehydrazide?
The InChIKey is DGUXGBQRBYBUOV-DHZHZOJOSA-N. The full InChI is InChI=1S/C15H14N2O/c16-17-15(18)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-11H,16H2,(H,17,18)/b11-8+.
What are the key properties of (E)-3-(4-phenylphenyl)prop-2-enehydrazide?
(E)-3-(4-phenylphenyl)prop-2-enehydrazide has a molecular weight of 238.29 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(4-phenylphenyl)prop-2-enehydrazide is sourced from PubChem (CID 122191258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).