4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide

C23H20N2O3 — CID 6234109

IUPAC4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide
SMILESO=C(/C=C/c1ccccc1)NNC(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H20N2O3/c26-22(16-11-18-7-3-1-4-8-18)24-25-23(27)20-12-14-21(15-13-20)28-17-19-9-5-2-6-10-19/h1-16H,17H2,(H,24,26)(H,25,27)/b16-11+
InChIKeyYTRXQTCHIMJCTI-LFIBNONCSA-N
MW372.42 g/mol
LogP3.74
Rot. Bonds6

About 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide

4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide (PubChem CID 6234109) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide.

Molecular Properties

Compound Name4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide
PubChem CID6234109
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide
SMILESO=C(/C=C/c1ccccc1)NNC(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C23H20N2O3/c26-22(16-11-18-7-3-1-4-8-18)24-25-23(27)20-12-14-21(15-13-20)28-17-19-9-5-2-6-10-19/h1-16H,17H2,(H,24,26)(H,25,27)/b16-11+
InChIKeyYTRXQTCHIMJCTI-LFIBNONCSA-N
XLogP3.74
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-N'-[(E)-3-(4-phenylmethoxyphenyl)prop-2-enoyl]benzohydrazide
CID 22831284
(E)-4-oxo-4-[2-(4-phenylmethoxybenzoyl)hydrazinyl]but-2-enoic acid
CID 6234104
N'-(3-naphthalen-1-ylprop-2-enoyl)-4-phenylmethoxybenzohydrazide
CID 4933147
4-chloro-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide
CID 959776
(1E,4E)-1,5-bis(4-phenylmethoxyphenyl)penta-1,4-dien-3-one
CID 6475153
(E)-3-(3-nitrophenyl)-N-[[(4-phenylmethoxybenzoyl)amino]carbamothioyl]prop-2-enamide
CID 17176458
methyl 4-[[(4-phenylmethoxybenzoyl)amino]carbamoyl]benzoate
CID 17178415
4-tert-butyl-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide
CID 923514
N-[(Z)-benzylideneamino]-4-phenylmethoxybenzamide
CID 5401763
3-(4-phenylmethoxyphenyl)prop-2-enoyl 3-(4-phenylmethoxyphenyl)prop-2-enoate
CID 139936599
3-(4-phenylmethoxyphenyl)prop-2-enoyl chloride
CID 86156285
methyl 4-[[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]amino]carbamoyl]benzoate
CID 21406094

Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide?
The IUPAC name of 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide (CID 6234109) is 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide.
What is the SMILES notation for 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide?
The canonical SMILES for 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide is O=C(/C=C/c1ccccc1)NNC(=O)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide?
The InChIKey is YTRXQTCHIMJCTI-LFIBNONCSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-22(16-11-18-7-3-1-4-8-18)24-25-23(27)20-12-14-21(15-13-20)28-17-19-9-5-2-6-10-19/h1-16H,17H2,(H,24,26)(H,25,27)/b16-11+.
What are the key properties of 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide?
4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide has a molecular weight of 372.42 g/mol, XLogP of 3.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxy-N'-[(E)-3-phenylprop-2-enoyl]benzohydrazide is sourced from PubChem (CID 6234109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).