N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide

C14H14N2O4 — CID 5405057

IUPACN-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)N/N=C\c2ccco2)cc1
InChIInChI=1S/C14H14N2O4/c1-18-11-4-6-12(7-5-11)20-10-14(17)16-15-9-13-3-2-8-19-13/h2-9H,10H2,1H3,(H,16,17)/b15-9-
InChIKeyWBQUSZKOUNJIQJ-DHDCSXOGSA-N
MW274.28 g/mol
LogP1.82
Rot. Bonds6

About N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide

N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide (PubChem CID 5405057) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide
PubChem CID5405057
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC NameN-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)N/N=C\c2ccco2)cc1
InChIInChI=1S/C14H14N2O4/c1-18-11-4-6-12(7-5-11)20-10-14(17)16-15-9-13-3-2-8-19-13/h2-9H,10H2,1H3,(H,16,17)/b15-9-
InChIKeyWBQUSZKOUNJIQJ-DHDCSXOGSA-N
XLogP1.82
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide?
The IUPAC name of N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide (CID 5405057) is N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide?
The canonical SMILES for N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide is COc1ccc(OCC(=O)N/N=C\c2ccco2)cc1.
What is the InChIKey of N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide?
The InChIKey is WBQUSZKOUNJIQJ-DHDCSXOGSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-18-11-4-6-12(7-5-11)20-10-14(17)16-15-9-13-3-2-8-19-13/h2-9H,10H2,1H3,(H,16,17)/b15-9-.
What are the key properties of N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide?
N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide has a molecular weight of 274.28 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-furan-2-ylmethylideneamino]-2-(4-methoxyphenoxy)acetamide is sourced from PubChem (CID 5405057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).