(E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide

C18H19NO — CID 11184674

IUPAC(E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide
SMILESCN(CCc1ccccc1)C(=O)/C=C/c1ccccc1
InChIInChI=1S/C18H19NO/c1-19(15-14-17-10-6-3-7-11-17)18(20)13-12-16-8-4-2-5-9-16/h2-13H,14-15H2,1H3/b13-12+
InChIKeyFXOMVQIRHBIDBI-OUKQBFOZSA-N
MW265.36 g/mol
LogP3.40
Rot. Bonds5

About (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide

(E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide (PubChem CID 11184674) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide
PubChem CID11184674
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name(E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide
SMILESCN(CCc1ccccc1)C(=O)/C=C/c1ccccc1
InChIInChI=1S/C18H19NO/c1-19(15-14-17-10-6-3-7-11-17)18(20)13-12-16-8-4-2-5-9-16/h2-13H,14-15H2,1H3/b13-12+
InChIKeyFXOMVQIRHBIDBI-OUKQBFOZSA-N
XLogP3.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(3-aminophenyl)-N-methyl-N-(2-phenylethyl)prop-2-enamide
CID 115343324
N-[2-(1,3-benzodioxol-5-yl)ethyl]-N-methyl-3-phenylprop-2-enamide
CID 69227483
(E)-N-(3-amino-3-sulfanylidenepropyl)-N-methyl-3-phenylprop-2-enamide
CID 82104134
(E)-N-methyl-3-(4-phenylphenyl)-N-propylprop-2-enamide
CID 18737343
(Z)-N,N-dibenzyl-3-phenylprop-2-enamide
CID 11163228
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-3-phenylprop-2-enamide
CID 56983782
N-methyl-N-[(2-methylphenyl)methyl]-3-phenylprop-2-enamide
CID 102603359
(E)-4-[2-(4-ethylphenyl)ethyl-methylamino]-4-oxobut-2-enoic acid
CID 115177305
(E)-4-[methyl-[2-(4-methylphenyl)ethyl]amino]-4-oxobut-2-enoic acid
CID 115177304
N-(furan-2-ylmethyl)-3-phenyl-N-(2-phenylethyl)prop-2-enamide
CID 772554
(E)-N-methyl-N-(4-methylpenta-2,3-dienyl)-3-phenylprop-2-enamide
CID 53248036
N-benzyl-3-(3-fluorophenyl)-N-methylprop-2-enamide
CID 78774303

Frequently Asked Questions

What is the IUPAC name of (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
The IUPAC name of (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide (CID 11184674) is (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide.
What is the SMILES notation for (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
The canonical SMILES for (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide is CN(CCc1ccccc1)C(=O)/C=C/c1ccccc1.
What is the InChIKey of (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
The InChIKey is FXOMVQIRHBIDBI-OUKQBFOZSA-N. The full InChI is InChI=1S/C18H19NO/c1-19(15-14-17-10-6-3-7-11-17)18(20)13-12-16-8-4-2-5-9-16/h2-13H,14-15H2,1H3/b13-12+.
What are the key properties of (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide?
(E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide has a molecular weight of 265.36 g/mol, XLogP of 3.40, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methyl-3-phenyl-N-(2-phenylethyl)prop-2-enamide is sourced from PubChem (CID 11184674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).