(E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide

C24H22N2O4 — CID 19631126

IUPAC(E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide
SMILESO=C(Nc1ccccc1C(=O)N1CCOCC1)/C(=C/c1ccco1)c1ccccc1
InChIInChI=1S/C24H22N2O4/c27-23(21(17-19-9-6-14-30-19)18-7-2-1-3-8-18)25-22-11-5-4-10-20(22)24(28)26-12-15-29-16-13-26/h1-11,14,17H,12-13,15-16H2,(H,25,27)/b21-17+
InChIKeyNKEQVORSLYJKEJ-HEHNFIMWSA-N
MW402.45 g/mol
LogP3.93
Rot. Bonds5

About (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide

(E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide (PubChem CID 19631126) has the molecular formula C24H22N2O4 and a molecular weight of 402.45 g/mol. Its IUPAC name is (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide
PubChem CID19631126
Molecular FormulaC24H22N2O4
Molecular Weight402.45 g/mol
Exact Mass402.16
IUPAC Name(E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide
SMILESO=C(Nc1ccccc1C(=O)N1CCOCC1)/C(=C/c1ccco1)c1ccccc1
InChIInChI=1S/C24H22N2O4/c27-23(21(17-19-9-6-14-30-19)18-7-2-1-3-8-18)25-22-11-5-4-10-20(22)24(28)26-12-15-29-16-13-26/h1-11,14,17H,12-13,15-16H2,(H,25,27)/b21-17+
InChIKeyNKEQVORSLYJKEJ-HEHNFIMWSA-N
XLogP3.93
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[(Z)-furan-2-ylmethylideneamino]-N-[2-(morpholine-4-carbonyl)phenyl]oxamide
CID 6027752
N-(furan-2-ylmethyl)-2-[[(Z)-3-(furan-2-yl)-2-phenylprop-2-enoyl]amino]benzamide
CID 2111571
3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 35329167
N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide
CID 17080133
ethyl 4-[2-[[(E)-2,3-diphenylprop-2-enoyl]amino]benzoyl]piperazine-1-carboxylate
CID 17312009
methyl N-[2-(morpholine-4-carbonyl)phenyl]carbamate
CID 740590
N'-[(2-hydroxyphenyl)methylideneamino]-N-[2-(morpholine-4-carbonyl)phenyl]oxamide
CID 4559649
3-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
CID 727290
N-[2-(morpholine-4-carbonyl)phenyl]-4-phenoxybenzamide
CID 35325582
4-fluoro-N-[[2-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide
CID 4933228
N'-[(Z)-(4-hydroxyphenyl)methylideneamino]-N-[2-(morpholine-4-carbonyl)phenyl]oxamide
CID 136690328
N-[2-(morpholine-4-carbonyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 71895877

Frequently Asked Questions

What is the IUPAC name of (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide?
The IUPAC name of (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide (CID 19631126) is (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide.
What is the SMILES notation for (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide?
The canonical SMILES for (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide is O=C(Nc1ccccc1C(=O)N1CCOCC1)/C(=C/c1ccco1)c1ccccc1.
What is the InChIKey of (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide?
The InChIKey is NKEQVORSLYJKEJ-HEHNFIMWSA-N. The full InChI is InChI=1S/C24H22N2O4/c27-23(21(17-19-9-6-14-30-19)18-7-2-1-3-8-18)25-22-11-5-4-10-20(22)24(28)26-12-15-29-16-13-26/h1-11,14,17H,12-13,15-16H2,(H,25,27)/b21-17+.
What are the key properties of (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide?
(E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide has a molecular weight of 402.45 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(furan-2-yl)-N-[2-(morpholine-4-carbonyl)phenyl]-2-phenylprop-2-enamide is sourced from PubChem (CID 19631126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).