N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide

C14H14N2O3 — CID 6896656

IUPACN-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)N/N=C/c2ccco2)cc1
InChIInChI=1S/C14H14N2O3/c1-18-12-6-4-11(5-7-12)9-14(17)16-15-10-13-3-2-8-19-13/h2-8,10H,9H2,1H3,(H,16,17)/b15-10+
InChIKeyRZDNKSDZCVQZNO-XNTDXEJSSA-N
MW258.28 g/mol
LogP1.98
Rot. Bonds5

About N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide

N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide (PubChem CID 6896656) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide
PubChem CID6896656
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC NameN-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)N/N=C/c2ccco2)cc1
InChIInChI=1S/C14H14N2O3/c1-18-12-6-4-11(5-7-12)9-14(17)16-15-10-13-3-2-8-19-13/h2-8,10H,9H2,1H3,(H,16,17)/b15-10+
InChIKeyRZDNKSDZCVQZNO-XNTDXEJSSA-N
XLogP1.98
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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Related Compounds

N-[(E)-furan-2-ylmethylideneamino]-2-[(4-methoxyphenyl)methylsulfanyl]acetamide
CID 6877510
2-(4-ethylphenyl)-N-(furan-2-ylmethylideneamino)acetamide
CID 165354335
N-[(Z)-furan-2-ylmethylideneamino]-4-methoxybenzamide
CID 5372129
N-[(E)-(5-bromofuran-2-yl)methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 21208726
(E)-N-[(E)-furan-2-ylmethylideneamino]-N'-[(Z)-furan-2-ylmethylideneamino]hex-3-enediamide
CID 45050499
N,N'-bis(furan-2-ylmethylideneamino)decanediamide
CID 5226719
N-[(4-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 968721
2-(4-methoxyphenyl)-N-(1H-pyrrol-2-ylmethylideneamino)acetamide
CID 969187
N-[(Z)-furan-2-ylmethylideneamino]-2-naphthalen-2-yloxyacetamide
CID 5405073
2-(4-methoxyphenyl)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 6258756
2-(4-fluorophenoxy)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
CID 5368979
N-[(E)-furan-2-ylmethylideneamino]-2-(1-methylpyrrol-2-yl)acetamide
CID 6862517

Frequently Asked Questions

What is the IUPAC name of N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide (CID 6896656) is N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)N/N=C/c2ccco2)cc1.
What is the InChIKey of N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide?
The InChIKey is RZDNKSDZCVQZNO-XNTDXEJSSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-18-12-6-4-11(5-7-12)9-14(17)16-15-10-13-3-2-8-19-13/h2-8,10H,9H2,1H3,(H,16,17)/b15-10+.
What are the key properties of N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide?
N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide has a molecular weight of 258.28 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-furan-2-ylmethylideneamino]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 6896656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).