2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide

C20H17N3O5 — CID 5440766

IUPAC2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide
SMILESC/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1
InChIInChI=1S/C20H17N3O5/c1-14(17-12-13-18(28-17)23(26)27)21-22-19(24)20(25,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,25H,1H3,(H,22,24)/b21-14-
InChIKeyQQPQWJOBBVGHJA-STZFKDTASA-N
MW379.37 g/mol
LogP2.96
Rot. Bonds6

About 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide

2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide (PubChem CID 5440766) has the molecular formula C20H17N3O5 and a molecular weight of 379.37 g/mol. Its IUPAC name is 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide
PubChem CID5440766
Molecular FormulaC20H17N3O5
Molecular Weight379.37 g/mol
Exact Mass379.12
IUPAC Name2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide
SMILESC/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1
InChIInChI=1S/C20H17N3O5/c1-14(17-12-13-18(28-17)23(26)27)21-22-19(24)20(25,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,25H,1H3,(H,22,24)/b21-14-
InChIKeyQQPQWJOBBVGHJA-STZFKDTASA-N
XLogP2.96
TPSA117.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.37
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-hydroxy-N-[[5-(3-nitrophenyl)furan-2-yl]methylideneamino]benzamide
CID 6868808
2-hydroxy-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-phenylacetamide
CID 5334509
N'-[(E)-(5-nitrofuran-2-yl)methylidene]-3-(4-propoxyphenyl)propanehydrazide
CID 9663344
N'-[(5-nitro-2-furyl)methylene]benzohydrazide
CID 5331853
N'-[(5-nitro-2-furyl)methylene]-4-biphenylcarbohydrazide
CID 6870015
2-hydroxy-N'-[1-(5-methyl-2-furyl)ethylidene]-2,2-diphenylacetohydrazide
CID 7240954
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-4-octylbenzamide
CID 145950559
4-hexyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide
CID 145955127
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-phenoxybenzamide
CID 118733695
N'-{[5-(dimethylamino)-2-furyl]methylene}-2-hydroxy-2,2-diphenylacetohydrazide
CID 5337355
4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide
CID 5391584
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-4-propan-2-ylbenzamide
CID 5796895

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide?
The IUPAC name of 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide (CID 5440766) is 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide.
What is the SMILES notation for 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide?
The canonical SMILES for 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide is C/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1.
What is the InChIKey of 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide?
The InChIKey is QQPQWJOBBVGHJA-STZFKDTASA-N. The full InChI is InChI=1S/C20H17N3O5/c1-14(17-12-13-18(28-17)23(26)27)21-22-19(24)20(25,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,25H,1H3,(H,22,24)/b21-14-.
What are the key properties of 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide?
2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide has a molecular weight of 379.37 g/mol, XLogP of 2.96, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(Z)-1-(5-nitrofuran-2-yl)ethylideneamino]-2,2-diphenylacetamide is sourced from PubChem (CID 5440766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).