N-(1,3-diphenylprop-2-enylideneamino)benzamide

C22H18N2O — CID 3091818

IUPACN-(1,3-diphenylprop-2-enylideneamino)benzamide
SMILESO=C(NN=C(C=Cc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H18N2O/c25-22(20-14-8-3-9-15-20)24-23-21(19-12-6-2-7-13-19)17-16-18-10-4-1-5-11-18/h1-17H,(H,24,25)
InChIKeyHFXMSEOARJHWKQ-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.53
Rot. Bonds5

About N-(1,3-diphenylprop-2-enylideneamino)benzamide

N-(1,3-diphenylprop-2-enylideneamino)benzamide (PubChem CID 3091818) has the molecular formula C22H18N2O and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(1,3-diphenylprop-2-enylideneamino)benzamide.

Molecular Properties

Compound NameN-(1,3-diphenylprop-2-enylideneamino)benzamide
PubChem CID3091818
Molecular FormulaC22H18N2O
Molecular Weight326.40 g/mol
Exact Mass326.14
IUPAC NameN-(1,3-diphenylprop-2-enylideneamino)benzamide
SMILESO=C(NN=C(C=Cc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H18N2O/c25-22(20-14-8-3-9-15-20)24-23-21(19-12-6-2-7-13-19)17-16-18-10-4-1-5-11-18/h1-17H,(H,24,25)
InChIKeyHFXMSEOARJHWKQ-UHFFFAOYSA-N
XLogP4.53
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

4-acetamido-N-(1,3-diphenylprop-2-enylideneamino)benzamide
CID 4510499
2-chloro-N-[(Z)-[(Z)-1,3-diphenylprop-2-enylidene]amino]benzamide
CID 93028108
N-[(E)-[(Z)-1,3-diphenylprop-2-enylidene]amino]-4-(propanoylamino)benzamide
CID 93028204
N-[[(E)-4-phenylbut-3-en-2-ylidene]amino]benzamide
CID 724511
4-(butanoylamino)-N-(1,3-diphenylprop-2-enylideneamino)benzamide
CID 3384778
N-[[(E)-1,3-diphenylprop-2-enylidene]amino]-2-phenylacetamide
CID 129460869
N-(1,3-diphenylprop-2-enylideneamino)-1-methylpyrazole-3-carboxamide
CID 707960
N'-[(Z)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide
CID 6514335
4-hydroxy-N-[[3-(2-nitrophenyl)-1-phenylprop-2-enylidene]amino]benzamide
CID 1009768
N-(1,3-diphenylprop-2-enylideneamino)-2-naphthalen-1-yloxyacetamide
CID 3255207
4-bromo-N-[(E)-[(E)-3-(2-nitrophenyl)-1-phenylprop-2-enylidene]amino]benzamide
CID 92652533
N-[(Z)-[(Z)-1,3-diphenylprop-2-enylidene]amino]-2-(2-methylanilino)acetamide
CID 93046781

Frequently Asked Questions

What is the IUPAC name of N-(1,3-diphenylprop-2-enylideneamino)benzamide?
The IUPAC name of N-(1,3-diphenylprop-2-enylideneamino)benzamide (CID 3091818) is N-(1,3-diphenylprop-2-enylideneamino)benzamide.
What is the SMILES notation for N-(1,3-diphenylprop-2-enylideneamino)benzamide?
The canonical SMILES for N-(1,3-diphenylprop-2-enylideneamino)benzamide is O=C(NN=C(C=Cc1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(1,3-diphenylprop-2-enylideneamino)benzamide?
The InChIKey is HFXMSEOARJHWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O/c25-22(20-14-8-3-9-15-20)24-23-21(19-12-6-2-7-13-19)17-16-18-10-4-1-5-11-18/h1-17H,(H,24,25).
What are the key properties of N-(1,3-diphenylprop-2-enylideneamino)benzamide?
N-(1,3-diphenylprop-2-enylideneamino)benzamide has a molecular weight of 326.40 g/mol, XLogP of 4.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-diphenylprop-2-enylideneamino)benzamide is sourced from PubChem (CID 3091818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).