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

C17H15NO — CID 10377378

IUPAC(E)-N-ethenyl-N,3-diphenylprop-2-enamide
SMILESC=CN(C(=O)/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H15NO/c1-2-18(16-11-7-4-8-12-16)17(19)14-13-15-9-5-3-6-10-15/h2-14H,1H2/b14-13+
InChIKeyCGYQTAQUWAXLJL-BUHFOSPRSA-N
MW249.31 g/mol
LogP3.88
Rot. Bonds4

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

(E)-N-ethenyl-N,3-diphenylprop-2-enamide (PubChem CID 10377378) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is (E)-N-ethenyl-N,3-diphenylprop-2-enamide.

Molecular Properties

Compound Name(E)-N-ethenyl-N,3-diphenylprop-2-enamide
PubChem CID10377378
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name(E)-N-ethenyl-N,3-diphenylprop-2-enamide
SMILESC=CN(C(=O)/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H15NO/c1-2-18(16-11-7-4-8-12-16)17(19)14-13-15-9-5-3-6-10-15/h2-14H,1H2/b14-13+
InChIKeyCGYQTAQUWAXLJL-BUHFOSPRSA-N
XLogP3.88
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 53.88
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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Frequently Asked Questions

What is the IUPAC name of (E)-N-ethenyl-N,3-diphenylprop-2-enamide?
The IUPAC name of (E)-N-ethenyl-N,3-diphenylprop-2-enamide (CID 10377378) is (E)-N-ethenyl-N,3-diphenylprop-2-enamide.
What is the SMILES notation for (E)-N-ethenyl-N,3-diphenylprop-2-enamide?
The canonical SMILES for (E)-N-ethenyl-N,3-diphenylprop-2-enamide is C=CN(C(=O)/C=C/c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-N-ethenyl-N,3-diphenylprop-2-enamide?
The InChIKey is CGYQTAQUWAXLJL-BUHFOSPRSA-N. The full InChI is InChI=1S/C17H15NO/c1-2-18(16-11-7-4-8-12-16)17(19)14-13-15-9-5-3-6-10-15/h2-14H,1H2/b14-13+.
What are the key properties of (E)-N-ethenyl-N,3-diphenylprop-2-enamide?
(E)-N-ethenyl-N,3-diphenylprop-2-enamide has a molecular weight of 249.31 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-ethenyl-N,3-diphenylprop-2-enamide is sourced from PubChem (CID 10377378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).