N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide

C19H20N2O4 — CID 680240

IUPACN-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H20N2O4/c1-14-4-6-15(7-5-14)18(22)20-17(13-16-3-2-10-25-16)19(23)21-8-11-24-12-9-21/h2-7,10,13H,8-9,11-12H2,1H3,(H,20,22)/b17-13+
InChIKeyMWEFLESHHUWRHA-GHRIWEEISA-N
MW340.38 g/mol
LogP2.22
Rot. Bonds4

About N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide

N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide (PubChem CID 680240) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide
PubChem CID680240
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H20N2O4/c1-14-4-6-15(7-5-14)18(22)20-17(13-16-3-2-10-25-16)19(23)21-8-11-24-12-9-21/h2-7,10,13H,8-9,11-12H2,1H3,(H,20,22)/b17-13+
InChIKeyMWEFLESHHUWRHA-GHRIWEEISA-N
XLogP2.22
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide 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 N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide?
The IUPAC name of N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide (CID 680240) is N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide.
What is the SMILES notation for N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide?
The canonical SMILES for N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide is Cc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide?
The InChIKey is MWEFLESHHUWRHA-GHRIWEEISA-N. The full InChI is InChI=1S/C19H20N2O4/c1-14-4-6-15(7-5-14)18(22)20-17(13-16-3-2-10-25-16)19(23)21-8-11-24-12-9-21/h2-7,10,13H,8-9,11-12H2,1H3,(H,20,22)/b17-13+.
What are the key properties of N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide?
N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide has a molecular weight of 340.38 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-4-methylbenzamide is sourced from PubChem (CID 680240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).