(Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide

C17H17NO2 — CID 56968195

IUPAC(Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide
SMILESCO/C(=C\c1ccccc1)C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C17H17NO2/c1-13-8-10-15(11-9-13)18-17(19)16(20-2)12-14-6-4-3-5-7-14/h3-12H,1-2H3,(H,18,19)/b16-12-
InChIKeyVQNLQPQKZGAGNI-VBKFSLOCSA-N
MW267.33 g/mol
LogP3.62
Rot. Bonds4

About (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide

(Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide (PubChem CID 56968195) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide.

Molecular Properties

Compound Name(Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide
PubChem CID56968195
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name(Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide
SMILESCO/C(=C\c1ccccc1)C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C17H17NO2/c1-13-8-10-15(11-9-13)18-17(19)16(20-2)12-14-6-4-3-5-7-14/h3-12H,1-2H3,(H,18,19)/b16-12-
InChIKeyVQNLQPQKZGAGNI-VBKFSLOCSA-N
XLogP3.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide?
The IUPAC name of (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide (CID 56968195) is (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide.
What is the SMILES notation for (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide?
The canonical SMILES for (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide is CO/C(=C\c1ccccc1)C(=O)Nc1ccc(C)cc1.
What is the InChIKey of (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide?
The InChIKey is VQNLQPQKZGAGNI-VBKFSLOCSA-N. The full InChI is InChI=1S/C17H17NO2/c1-13-8-10-15(11-9-13)18-17(19)16(20-2)12-14-6-4-3-5-7-14/h3-12H,1-2H3,(H,18,19)/b16-12-.
What are the key properties of (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide?
(Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide has a molecular weight of 267.33 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methoxy-N-(4-methylphenyl)-3-phenylprop-2-enamide is sourced from PubChem (CID 56968195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).