(E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide

C19H18N2O3 — CID 110425854

IUPAC(E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide
SMILESC/C(=C\c1ccccc1)C(=O)Nc1ccc(N2CCOC2=O)cc1
InChIInChI=1S/C19H18N2O3/c1-14(13-15-5-3-2-4-6-15)18(22)20-16-7-9-17(10-8-16)21-11-12-24-19(21)23/h2-10,13H,11-12H2,1H3,(H,20,22)/b14-13+
InChIKeyVOYHYQNAWRBMKZ-BUHFOSPRSA-N
MW322.36 g/mol
LogP3.69
Rot. Bonds4

About (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide

(E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide (PubChem CID 110425854) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide.

Molecular Properties

Compound Name(E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide
PubChem CID110425854
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name(E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide
SMILESC/C(=C\c1ccccc1)C(=O)Nc1ccc(N2CCOC2=O)cc1
InChIInChI=1S/C19H18N2O3/c1-14(13-15-5-3-2-4-6-15)18(22)20-16-7-9-17(10-8-16)21-11-12-24-19(21)23/h2-10,13H,11-12H2,1H3,(H,20,22)/b14-13+
InChIKeyVOYHYQNAWRBMKZ-BUHFOSPRSA-N
XLogP3.69
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-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

Frequently Asked Questions

What is the IUPAC name of (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide?
The IUPAC name of (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide (CID 110425854) is (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide.
What is the SMILES notation for (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide?
The canonical SMILES for (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide is C/C(=C\c1ccccc1)C(=O)Nc1ccc(N2CCOC2=O)cc1.
What is the InChIKey of (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide?
The InChIKey is VOYHYQNAWRBMKZ-BUHFOSPRSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-14(13-15-5-3-2-4-6-15)18(22)20-16-7-9-17(10-8-16)21-11-12-24-19(21)23/h2-10,13H,11-12H2,1H3,(H,20,22)/b14-13+.
What are the key properties of (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide?
(E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide has a molecular weight of 322.36 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-phenylprop-2-enamide is sourced from PubChem (CID 110425854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).