(E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide

C19H19NO2 — CID 146661343

IUPAC(E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide
SMILESO=C(/C=C/c1ccccc1)N(c1ccccc1)C1CCOC1
InChIInChI=1S/C19H19NO2/c21-19(12-11-16-7-3-1-4-8-16)20(18-13-14-22-15-18)17-9-5-2-6-10-17/h1-12,18H,13-15H2/b12-11+
InChIKeyCUUQSVICMVXPCN-VAWYXSNFSA-N
MW293.37 g/mol
LogP3.52
Rot. Bonds4

About (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide

(E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide (PubChem CID 146661343) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide.

Molecular Properties

Compound Name(E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide
PubChem CID146661343
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name(E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide
SMILESO=C(/C=C/c1ccccc1)N(c1ccccc1)C1CCOC1
InChIInChI=1S/C19H19NO2/c21-19(12-11-16-7-3-1-4-8-16)20(18-13-14-22-15-18)17-9-5-2-6-10-17/h1-12,18H,13-15H2/b12-11+
InChIKeyCUUQSVICMVXPCN-VAWYXSNFSA-N
XLogP3.52
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(oxolan-3-yl)-N,3-diphenylprop-2-enamide?
The IUPAC name of (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide (CID 146661343) is (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide.
What is the SMILES notation for (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide?
The canonical SMILES for (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide is O=C(/C=C/c1ccccc1)N(c1ccccc1)C1CCOC1.
What is the InChIKey of (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide?
The InChIKey is CUUQSVICMVXPCN-VAWYXSNFSA-N. The full InChI is InChI=1S/C19H19NO2/c21-19(12-11-16-7-3-1-4-8-16)20(18-13-14-22-15-18)17-9-5-2-6-10-17/h1-12,18H,13-15H2/b12-11+.
What are the key properties of (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide?
(E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide has a molecular weight of 293.37 g/mol, XLogP of 3.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(oxolan-3-yl)-N,3-diphenylprop-2-enamide is sourced from PubChem (CID 146661343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).