2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide

C17H19N3O4 — CID 126015567

IUPAC2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide
SMILESCOc1ccccc1C(=O)N/N=C\c1ccc(N2CCOCC2)o1
InChIInChI=1S/C17H19N3O4/c1-22-15-5-3-2-4-14(15)17(21)19-18-12-13-6-7-16(24-13)20-8-10-23-11-9-20/h2-7,12H,8-11H2,1H3,(H,19,21)/b18-12-
InChIKeyAVLUHSZENORLBR-PDGQHHTCSA-N
MW329.36 g/mol
LogP1.89
Rot. Bonds5

About 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide

2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide (PubChem CID 126015567) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide
PubChem CID126015567
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC Name2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide
SMILESCOc1ccccc1C(=O)N/N=C\c1ccc(N2CCOCC2)o1
InChIInChI=1S/C17H19N3O4/c1-22-15-5-3-2-4-14(15)17(21)19-18-12-13-6-7-16(24-13)20-8-10-23-11-9-20/h2-7,12H,8-11H2,1H3,(H,19,21)/b18-12-
InChIKeyAVLUHSZENORLBR-PDGQHHTCSA-N
XLogP1.89
TPSA76.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_furan_A(15)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]-2-nitrobenzamide
CID 5410715
3-chloro-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide
CID 126021065
2-methoxy-N-[(5-nitrofuran-2-yl)methylideneamino]benzamide
CID 3612541
N-[[5-(4-fluorophenyl)furan-2-yl]methylideneamino]-2-methoxybenzamide
CID 3439847
3-methyl-N-[(5-morpholin-4-ylfuran-2-yl)methylideneamino]butanamide
CID 1278423
3,5-dimethoxy-N-[(5-piperidin-1-ylfuran-2-yl)methylideneamino]benzamide
CID 4291595
2-hydroxy-N-[(Z)-(2-methoxy-4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 6056382
2-methoxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide
CID 6861691
5-ethoxy-N-[(E)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]-1-benzofuran-2-carboxamide
CID 126193674
(Z)-2-cyano-N-(2-methoxyphenyl)-3-(5-morpholin-4-ylfuran-2-yl)prop-2-enamide
CID 19131342
N-[(2-hydroxyphenyl)methylideneamino]-2-methoxybenzamide
CID 3470891
methyl 4-[[(2-methoxybenzoyl)hydrazinylidene]methyl]benzoate
CID 3669406

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide?
The IUPAC name of 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide (CID 126015567) is 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide.
What is the SMILES notation for 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide?
The canonical SMILES for 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide is COc1ccccc1C(=O)N/N=C\c1ccc(N2CCOCC2)o1.
What is the InChIKey of 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide?
The InChIKey is AVLUHSZENORLBR-PDGQHHTCSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-22-15-5-3-2-4-14(15)17(21)19-18-12-13-6-7-16(24-13)20-8-10-23-11-9-20/h2-7,12H,8-11H2,1H3,(H,19,21)/b18-12-.
What are the key properties of 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide?
2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide has a molecular weight of 329.36 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]benzamide is sourced from PubChem (CID 126015567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).