N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide

C21H19N3O5 — CID 55648126

IUPACN-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide
SMILESO=C(CNC(=O)c1ccoc1)NNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C21H19N3O5/c25-19(12-22-21(27)16-10-11-28-13-16)23-24-20(26)14-29-18-9-5-4-8-17(18)15-6-2-1-3-7-15/h1-11,13H,12,14H2,(H,22,27)(H,23,25)(H,24,26)
InChIKeyOSNIZWCZSJPGFD-UHFFFAOYSA-N
MW393.40 g/mol
LogP1.90
Rot. Bonds7

About N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide

N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide (PubChem CID 55648126) has the molecular formula C21H19N3O5 and a molecular weight of 393.40 g/mol. Its IUPAC name is N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide
PubChem CID55648126
Molecular FormulaC21H19N3O5
Molecular Weight393.40 g/mol
Exact Mass393.13
IUPAC NameN-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide
SMILESO=C(CNC(=O)c1ccoc1)NNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C21H19N3O5/c25-19(12-22-21(27)16-10-11-28-13-16)23-24-20(26)14-29-18-9-5-4-8-17(18)15-6-2-1-3-7-15/h1-11,13H,12,14H2,(H,22,27)(H,23,25)(H,24,26)
InChIKeyOSNIZWCZSJPGFD-UHFFFAOYSA-N
XLogP1.90
TPSA109.67 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.40
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-oxo-3-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]propyl]furan-3-carboxamide
CID 38858069
4-fluoro-N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]benzamide
CID 26840576
1-N',4-N'-bis[2-(2-phenylphenoxy)acetyl]benzene-1,4-dicarbohydrazide
CID 3554709
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372
[4-[[[2-(2-phenylphenoxy)acetyl]amino]carbamoyl]phenyl]methylurea
CID 55333341
2-[[[2-(2-phenylphenoxy)acetyl]amino]carbamoyl]benzoic acid
CID 5088878
2,6-difluoro-N'-[2-(2-phenylphenoxy)acetyl]benzohydrazide
CID 78771932
3-methyl-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 9470420
N'-[2-(2-phenylphenoxy)acetyl]-2-thiophen-2-ylacetohydrazide
CID 7978348
4-bromo-3,5-dimethoxy-N'-[2-(2-phenylphenoxy)acetyl]benzohydrazide
CID 27568544
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide?
The IUPAC name of N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide (CID 55648126) is N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide?
The canonical SMILES for N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide is O=C(CNC(=O)c1ccoc1)NNC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide?
The InChIKey is OSNIZWCZSJPGFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O5/c25-19(12-22-21(27)16-10-11-28-13-16)23-24-20(26)14-29-18-9-5-4-8-17(18)15-6-2-1-3-7-15/h1-11,13H,12,14H2,(H,22,27)(H,23,25)(H,24,26).
What are the key properties of N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide?
N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide has a molecular weight of 393.40 g/mol, XLogP of 1.90, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[2-[2-(2-phenylphenoxy)acetyl]hydrazinyl]ethyl]furan-3-carboxamide is sourced from PubChem (CID 55648126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).