N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide

C16H16N2O4S — CID 6284229

IUPACN-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide
SMILESO=C(N/C(=C\c1ccco1)C(=O)N1CCOCC1)c1ccsc1
InChIInChI=1S/C16H16N2O4S/c19-15(12-3-9-23-11-12)17-14(10-13-2-1-6-22-13)16(20)18-4-7-21-8-5-18/h1-3,6,9-11H,4-5,7-8H2,(H,17,19)/b14-10-
InChIKeyYXUKQEPCIFPLQL-UVTDQMKNSA-N
MW332.38 g/mol
LogP1.97
Rot. Bonds4

About N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide

N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide (PubChem CID 6284229) has the molecular formula C16H16N2O4S and a molecular weight of 332.38 g/mol. Its IUPAC name is N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide
PubChem CID6284229
Molecular FormulaC16H16N2O4S
Molecular Weight332.38 g/mol
Exact Mass332.08
IUPAC NameN-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide
SMILESO=C(N/C(=C\c1ccco1)C(=O)N1CCOCC1)c1ccsc1
InChIInChI=1S/C16H16N2O4S/c19-15(12-3-9-23-11-12)17-14(10-13-2-1-6-22-13)16(20)18-4-7-21-8-5-18/h1-3,6,9-11H,4-5,7-8H2,(H,17,19)/b14-10-
InChIKeyYXUKQEPCIFPLQL-UVTDQMKNSA-N
XLogP1.97
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.38
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-[1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide
CID 1163152
N-[(E)-1-(furan-2-yl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]benzamide
CID 5409301
N-[1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-3-phenylprop-2-enamide
CID 2921436
N-[(E)-1-(furan-2-yl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]furan-2-carboxamide
CID 892483
N-[(E)-3-(3-fluoroanilino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide
CID 5290963
N-[(Z)-1-(furan-2-yl)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 6946856
N-[(Z)-3-(3,5-dimethylpiperidin-1-yl)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 6526397
N-[(Z)-3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 6575923
N-[(E)-1-(furan-2-yl)-3-(3-methylpiperidin-1-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 6021081
4-chloro-N-[(Z)-1-(furan-2-yl)-3-(4-methylpiperidin-1-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 2302592
N-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide
CID 5445738
N-[(Z)-1-(5-iodofuran-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide
CID 19057172

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide?
The IUPAC name of N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide (CID 6284229) is N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide.
What is the SMILES notation for N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide?
The canonical SMILES for N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide is O=C(N/C(=C\c1ccco1)C(=O)N1CCOCC1)c1ccsc1.
What is the InChIKey of N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide?
The InChIKey is YXUKQEPCIFPLQL-UVTDQMKNSA-N. The full InChI is InChI=1S/C16H16N2O4S/c19-15(12-3-9-23-11-12)17-14(10-13-2-1-6-22-13)16(20)18-4-7-21-8-5-18/h1-3,6,9-11H,4-5,7-8H2,(H,17,19)/b14-10-.
What are the key properties of N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide?
N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide has a molecular weight of 332.38 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]thiophene-3-carboxamide is sourced from PubChem (CID 6284229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).