N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide

C17H14N2O4 — CID 725695

IUPACN'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide
SMILESO=C(COc1ccccc1)NNC(=O)c1cc2ccccc2o1
InChIInChI=1S/C17H14N2O4/c20-16(11-22-13-7-2-1-3-8-13)18-19-17(21)15-10-12-6-4-5-9-14(12)23-15/h1-10H,11H2,(H,18,20)(H,19,21)
InChIKeyOMZJUDVQPZJMTD-UHFFFAOYSA-N
MW310.31 g/mol
LogP2.27
Rot. Bonds4

About N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide

N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide (PubChem CID 725695) has the molecular formula C17H14N2O4 and a molecular weight of 310.31 g/mol. Its IUPAC name is N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide
PubChem CID725695
Molecular FormulaC17H14N2O4
Molecular Weight310.31 g/mol
Exact Mass310.10
IUPAC NameN'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide
SMILESO=C(COc1ccccc1)NNC(=O)c1cc2ccccc2o1
InChIInChI=1S/C17H14N2O4/c20-16(11-22-13-7-2-1-3-8-13)18-19-17(21)15-10-12-6-4-5-9-14(12)23-15/h1-10H,11H2,(H,18,20)(H,19,21)
InChIKeyOMZJUDVQPZJMTD-UHFFFAOYSA-N
XLogP2.27
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.31
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-Benzofurancarboxamide
CID 687121
Hdac3-IN-8
CID 166628045
5-fluoro-N-[[4-(propylaminocarbamoyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 166635529
5-[(2-Naphthyloxy)methyl]-2-furohydrazide
CID 726927
N'-benzoyl-2-furohydrazide
CID 687074
Furan-2-carboxylic acid N'-(3-phenyl-acryloyl)-hydrazide
CID 809418
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-furohydrazide
CID 876401
2-{[2-(1-Benzofuran-2-ylcarbonyl)hydrazinyl]carbonyl}benzoic acid
CID 919614
N-({[(4-Methoxyphenyl)methyl]carbamothioyl}amino)-1-benzofuran-2-carboxamide
CID 1143567
2-Benzofurancarboxamide,3-methyl-N-4-morpholinyl-(9CI)
CID 1246938
5-(Naphthalen-1-yloxymethyl)furan-2-carbohydrazide
CID 3791373
N'-(2-hydroxybenzoyl)-1-benzofuran-2-carbohydrazide
CID 7661749

Frequently Asked Questions

What is the IUPAC name of N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide?
The IUPAC name of N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide (CID 725695) is N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide.
What is the SMILES notation for N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide?
The canonical SMILES for N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide is O=C(COc1ccccc1)NNC(=O)c1cc2ccccc2o1.
What is the InChIKey of N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide?
The InChIKey is OMZJUDVQPZJMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O4/c20-16(11-22-13-7-2-1-3-8-13)18-19-17(21)15-10-12-6-4-5-9-14(12)23-15/h1-10H,11H2,(H,18,20)(H,19,21).
What are the key properties of N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide?
N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide has a molecular weight of 310.31 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-phenoxyacetyl)-1-benzofuran-2-carbohydrazide is sourced from PubChem (CID 725695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).