4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide

C24H24N2O2 — CID 177366331

IUPAC4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide
SMILESO=C(NCCO)c1ccc(NC/C(=C/c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c27-16-15-25-24(28)21-11-13-23(14-12-21)26-18-22(20-9-5-2-6-10-20)17-19-7-3-1-4-8-19/h1-14,17,26-27H,15-16,18H2,(H,25,28)/b22-17-
InChIKeyRURCXBXXOUAKLG-XLNRJJMWSA-N
MW372.47 g/mol
LogP4.06
Rot. Bonds8

About 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide

4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide (PubChem CID 177366331) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide
PubChem CID177366331
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide
SMILESO=C(NCCO)c1ccc(NC/C(=C/c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c27-16-15-25-24(28)21-11-13-23(14-12-21)26-18-22(20-9-5-2-6-10-20)17-19-7-3-1-4-8-19/h1-14,17,26-27H,15-16,18H2,(H,25,28)/b22-17-
InChIKeyRURCXBXXOUAKLG-XLNRJJMWSA-N
XLogP4.06
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-2,3-diphenylprop-2-enyl]aniline
CID 101023407
benzoic acid;N-(2-hydroxyethyl)benzamide
CID 68510330
4-[(2-fluorophenyl)methylamino]-N-(2-hydroxyethyl)benzamide
CID 43742171
N-[2-(4-chloroanilino)ethyl]benzamide
CID 15324175
N-[2-(hydroxymethylamino)ethyl]benzamide
CID 89240823
N-(2-hydroxyethyl)-4-(2-methylbutylamino)benzamide
CID 43742088
4-N-(2-anilinoethyl)benzene-1,4-dicarboxamide
CID 154348827
4-[(2-anilinoacetyl)amino]-N-butylbenzamide
CID 54810364
4-[(3-bromophenyl)methylamino]-N-(2-hydroxyethyl)benzamide
CID 43742098
N-(3-hydroxypropyl)-4-[2-[4-(3-hydroxypropylcarbamoyl)phenyl]ethenyl]benzamide
CID 71357848
2,3-diphenylprop-2-enylsulfamic acid
CID 174655398
N-[2-[2-(2-benzamidoethylamino)ethylamino]ethyl]benzamide
CID 86227273

Frequently Asked Questions

What is the IUPAC name of 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide (CID 177366331) is 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide is O=C(NCCO)c1ccc(NC/C(=C/c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide?
The InChIKey is RURCXBXXOUAKLG-XLNRJJMWSA-N. The full InChI is InChI=1S/C24H24N2O2/c27-16-15-25-24(28)21-11-13-23(14-12-21)26-18-22(20-9-5-2-6-10-20)17-19-7-3-1-4-8-19/h1-14,17,26-27H,15-16,18H2,(H,25,28)/b22-17-.
What are the key properties of 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide?
4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide has a molecular weight of 372.47 g/mol, XLogP of 4.06, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(E)-2,3-diphenylprop-2-enyl]amino]-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 177366331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).