(E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide

C23H21NO2 — CID 6522812

IUPAC(E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide
SMILESCCOc1ccccc1NC(=O)/C(=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C23H21NO2/c1-2-26-22-16-10-9-15-21(22)24-23(25)20(19-13-7-4-8-14-19)17-18-11-5-3-6-12-18/h3-17H,2H2,1H3,(H,24,25)/b20-17+
InChIKeyLRIVLYKUNNQWCL-LVZFUZTISA-N
MW343.43 g/mol
LogP5.26
Rot. Bonds6

About (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide

(E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide (PubChem CID 6522812) has the molecular formula C23H21NO2 and a molecular weight of 343.43 g/mol. Its IUPAC name is (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide.

Molecular Properties

Compound Name(E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide
PubChem CID6522812
Molecular FormulaC23H21NO2
Molecular Weight343.43 g/mol
Exact Mass343.16
IUPAC Name(E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide
SMILESCCOc1ccccc1NC(=O)/C(=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C23H21NO2/c1-2-26-22-16-10-9-15-21(22)24-23(25)20(19-13-7-4-8-14-19)17-18-11-5-3-6-12-18/h3-17H,2H2,1H3,(H,24,25)/b20-17+
InChIKeyLRIVLYKUNNQWCL-LVZFUZTISA-N
XLogP5.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.43
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-[[(E)-2,3-diphenylprop-2-enoyl]amino]benzoate
CID 19165915
(Z)-N-(2-methoxy-4-methylphenyl)-2,3-diphenylprop-2-enamide
CID 6140104
N-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-2-phenylprop-2-enamide
CID 1316446
ethyl 4-[2-[[(E)-2,3-diphenylprop-2-enoyl]amino]benzoyl]piperazine-1-carboxylate
CID 17312009
ethyl N-[(Z)-2,3-diphenylprop-2-enoyl]carbamate
CID 11289421
(E)-2,3-dichloro-4-(2-ethoxyanilino)-4-oxobut-2-enoic acid
CID 852528
N'-(2-ethoxyphenyl)-N-(2-phenylethyl)oxamide
CID 2274023
(E)-N-(2-methoxy-5-methylphenyl)-2,3-diphenylprop-2-enamide
CID 731540
2-[3-[[(E)-3-(4-ethoxyphenyl)-2-phenylprop-2-enoyl]amino]-4-hydroxyphenyl]acetic acid
CID 108764289
(E)-N-[(2-ethoxyphenyl)methyl]-3-(4-methoxyphenyl)-2-phenylprop-2-enamide
CID 28576235
ethyl 2-[[(E)-3-(4-methoxyphenyl)-2-phenylprop-2-enoyl]amino]benzoate
CID 1316307
N'-(2-ethoxyphenyl)-N-(4-iodophenyl)oxamide
CID 108531107

Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide?
The IUPAC name of (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide (CID 6522812) is (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide.
What is the SMILES notation for (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide?
The canonical SMILES for (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide is CCOc1ccccc1NC(=O)/C(=C/c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide?
The InChIKey is LRIVLYKUNNQWCL-LVZFUZTISA-N. The full InChI is InChI=1S/C23H21NO2/c1-2-26-22-16-10-9-15-21(22)24-23(25)20(19-13-7-4-8-14-19)17-18-11-5-3-6-12-18/h3-17H,2H2,1H3,(H,24,25)/b20-17+.
What are the key properties of (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide?
(E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide has a molecular weight of 343.43 g/mol, XLogP of 5.26, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-ethoxyphenyl)-2,3-diphenylprop-2-enamide is sourced from PubChem (CID 6522812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).