N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide

C20H18N2O5 — CID 561942

IUPACN'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide
SMILESO=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccco1
InChIInChI=1S/C20H18N2O5/c23-19(21-22-20(24)18-7-4-12-25-18)14-27-17-10-8-16(9-11-17)26-13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,21,23)(H,22,24)
InChIKeyOYLZIZKNFZUSPA-UHFFFAOYSA-N
MW366.37 g/mol
LogP2.70
Rot. Bonds7

About N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide

N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide (PubChem CID 561942) has the molecular formula C20H18N2O5 and a molecular weight of 366.37 g/mol. Its IUPAC name is N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide
PubChem CID561942
Molecular FormulaC20H18N2O5
Molecular Weight366.37 g/mol
Exact Mass366.12
IUPAC NameN'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide
SMILESO=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccco1
InChIInChI=1S/C20H18N2O5/c23-19(21-22-20(24)18-7-4-12-25-18)14-27-17-10-8-16(9-11-17)26-13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,21,23)(H,22,24)
InChIKeyOYLZIZKNFZUSPA-UHFFFAOYSA-N
XLogP2.70
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.37
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide?
The IUPAC name of N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide (CID 561942) is N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide.
What is the SMILES notation for N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide?
The canonical SMILES for N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide is O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccco1.
What is the InChIKey of N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide?
The InChIKey is OYLZIZKNFZUSPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O5/c23-19(21-22-20(24)18-7-4-12-25-18)14-27-17-10-8-16(9-11-17)26-13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide?
N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide has a molecular weight of 366.37 g/mol, XLogP of 2.70, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-phenylmethoxyphenoxy)acetyl]furan-2-carbohydrazide is sourced from PubChem (CID 561942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).