(E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide

C18H19NO — CID 969096

IUPAC(E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide
SMILESCc1ccc(/C=C/C(=O)Nc2ccc(C)cc2C)cc1
InChIInChI=1S/C18H19NO/c1-13-4-7-16(8-5-13)9-11-18(20)19-17-10-6-14(2)12-15(17)3/h4-12H,1-3H3,(H,19,20)/b11-9+
InChIKeyCREVEGUYRUKQBQ-PKNBQFBNSA-N
MW265.36 g/mol
LogP4.26
Rot. Bonds3

About (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide

(E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide (PubChem CID 969096) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide
PubChem CID969096
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name(E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide
SMILESCc1ccc(/C=C/C(=O)Nc2ccc(C)cc2C)cc1
InChIInChI=1S/C18H19NO/c1-13-4-7-16(8-5-13)9-11-18(20)19-17-10-6-14(2)12-15(17)3/h4-12H,1-3H3,(H,19,20)/b11-9+
InChIKeyCREVEGUYRUKQBQ-PKNBQFBNSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-bromophenyl)-N-(2,4-dimethylphenyl)prop-2-enamide
CID 4256749
(E)-N-(4-fluoro-2-methylphenyl)-3-(4-methylphenyl)prop-2-enamide
CID 8863833
(E)-N-(2,4-dimethylphenyl)-3-[4-(methanesulfonamido)phenyl]prop-2-enamide
CID 31244061
(E)-3-(4-bromophenyl)-N-(4-hydroxy-2-methylphenyl)prop-2-enamide
CID 17341892
N-[2-methoxy-4-[3-methoxy-4-[3-(4-methylphenyl)prop-2-enoylamino]phenyl]phenyl]-3-(4-methylphenyl)prop-2-enamide
CID 4200270
(E)-N-(2-amino-4-methylphenyl)-3-(4-chlorophenyl)prop-2-enamide
CID 28867709
(E)-N-(2,4-dimethylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 2600144
(E)-N'-[2-(2,4-dimethylanilino)acetyl]-3-(4-methylphenyl)prop-2-enehydrazide
CID 9432686
N-[(2,4-dimethylphenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
CID 920780
(E)-N-(2,4-dimethylphenyl)-4,4-dimethylpent-2-enamide
CID 101271751
N-(2-hydroxy-4-methylphenyl)-3-phenylprop-2-enamide
CID 4248844
(E)-N-(2,4-dimethylphenyl)-3-thiophen-2-ylprop-2-enamide
CID 922914

Frequently Asked Questions

What is the IUPAC name of (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide?
The IUPAC name of (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide (CID 969096) is (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide.
What is the SMILES notation for (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide?
The canonical SMILES for (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide is Cc1ccc(/C=C/C(=O)Nc2ccc(C)cc2C)cc1.
What is the InChIKey of (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide?
The InChIKey is CREVEGUYRUKQBQ-PKNBQFBNSA-N. The full InChI is InChI=1S/C18H19NO/c1-13-4-7-16(8-5-13)9-11-18(20)19-17-10-6-14(2)12-15(17)3/h4-12H,1-3H3,(H,19,20)/b11-9+.
What are the key properties of (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide?
(E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide has a molecular weight of 265.36 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2,4-dimethylphenyl)-3-(4-methylphenyl)prop-2-enamide is sourced from PubChem (CID 969096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).