(E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide

C18H19NO4 — CID 9096903

IUPAC(E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1cc(NC(=O)/C=C/c2ccccc2OC)cc(OC)c1
InChIInChI=1S/C18H19NO4/c1-21-15-10-14(11-16(12-15)22-2)19-18(20)9-8-13-6-4-5-7-17(13)23-3/h4-12H,1-3H3,(H,19,20)/b9-8+
InChIKeyLTJWIPPQZFLHAI-CMDGGOBGSA-N
MW313.35 g/mol
LogP3.36
Rot. Bonds6

About (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide

(E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide (PubChem CID 9096903) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide
PubChem CID9096903
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC Name(E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1cc(NC(=O)/C=C/c2ccccc2OC)cc(OC)c1
InChIInChI=1S/C18H19NO4/c1-21-15-10-14(11-16(12-15)22-2)19-18(20)9-8-13-6-4-5-7-17(13)23-3/h4-12H,1-3H3,(H,19,20)/b9-8+
InChIKeyLTJWIPPQZFLHAI-CMDGGOBGSA-N
XLogP3.36
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)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

(E)-N-(3,5-dimethoxyphenyl)-3-phenylprop-2-enamide
CID 874970
(E)-N-(4-iodophenyl)-3-(2-methoxyphenyl)prop-2-enamide
CID 1308180
N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide
CID 123173944
(E)-3-(2-methoxyphenyl)-N-(4-prop-2-enoxyphenyl)prop-2-enamide
CID 6235261
(E)-N-(3-cyanophenyl)-3-(2-methoxyphenyl)prop-2-enamide
CID 2707623
5-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]-2-methylbenzoic acid
CID 17297353
3-(2-methoxyphenyl)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
CID 5114432
(E)-3-(2-methoxyphenyl)-N-(2,4,6-trimethylphenyl)prop-2-enamide
CID 966729
(E)-N-(5-acetamido-2-methoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide
CID 26243278
(E)-3-(2,5-dimethoxyphenyl)-N-(3,5-dimethylphenyl)prop-2-enamide
CID 2683290
(E)-N-(2-bromophenyl)-3-(2-methoxyphenyl)prop-2-enamide
CID 734257
N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)prop-2-enamide
CID 4023340

Frequently Asked Questions

What is the IUPAC name of (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide?
The IUPAC name of (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide (CID 9096903) is (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide.
What is the SMILES notation for (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide?
The canonical SMILES for (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide is COc1cc(NC(=O)/C=C/c2ccccc2OC)cc(OC)c1.
What is the InChIKey of (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide?
The InChIKey is LTJWIPPQZFLHAI-CMDGGOBGSA-N. The full InChI is InChI=1S/C18H19NO4/c1-21-15-10-14(11-16(12-15)22-2)19-18(20)9-8-13-6-4-5-7-17(13)23-3/h4-12H,1-3H3,(H,19,20)/b9-8+.
What are the key properties of (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide?
(E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide has a molecular weight of 313.35 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(3,5-dimethoxyphenyl)-3-(2-methoxyphenyl)prop-2-enamide is sourced from PubChem (CID 9096903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).