3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide

C14H16N2O4 — CID 63587007

IUPAC3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide
SMILESNNC(=O)c1cccc(OCCOCc2ccco2)c1
InChIInChI=1S/C14H16N2O4/c15-16-14(17)11-3-1-4-12(9-11)20-8-7-18-10-13-5-2-6-19-13/h1-6,9H,7-8,10,15H2,(H,16,17)
InChIKeyJVHFXRUAJAGXAL-UHFFFAOYSA-N
MW276.29 g/mol
LogP1.48
Rot. Bonds7

About 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide

3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide (PubChem CID 63587007) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide.

Molecular Properties

Compound Name3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide
PubChem CID63587007
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide
SMILESNNC(=O)c1cccc(OCCOCc2ccco2)c1
InChIInChI=1S/C14H16N2O4/c15-16-14(17)11-3-1-4-12(9-11)20-8-7-18-10-13-5-2-6-19-13/h1-6,9H,7-8,10,15H2,(H,16,17)
InChIKeyJVHFXRUAJAGXAL-UHFFFAOYSA-N
XLogP1.48
TPSA86.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(3-bromophenoxy)ethoxymethyl]furan
CID 54970802
3-[2-(4-methylphenoxy)ethoxy]benzohydrazide
CID 63575513
3-amino-N-[3-(furan-2-ylmethoxy)propyl]benzamide
CID 61275519
3-(2-ethoxyethoxy)-N-[4-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 28638494
3-pentoxybenzohydrazide
CID 54793157
N-(furan-2-ylmethyl)-3-(3-methylbutoxy)benzamide
CID 4981718
3-[2-(oxetan-3-yloxy)ethoxy]benzohydrazide
CID 102608462
3-heptoxybenzohydrazide
CID 54793165
3-hexoxybenzohydrazide
CID 54793158
3-(2-hydrazinyl-2-oxoethoxy)benzohydrazide
CID 6420585
N'-benzoyl-3-(2-phenoxyethoxy)benzohydrazide
CID 4955128
2-[2-[2-[2-[2-(furan-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxymethyl]furan
CID 102488556

Frequently Asked Questions

What is the IUPAC name of 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide?
The IUPAC name of 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide (CID 63587007) is 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide.
What is the SMILES notation for 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide?
The canonical SMILES for 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide is NNC(=O)c1cccc(OCCOCc2ccco2)c1.
What is the InChIKey of 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide?
The InChIKey is JVHFXRUAJAGXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c15-16-14(17)11-3-1-4-12(9-11)20-8-7-18-10-13-5-2-6-19-13/h1-6,9H,7-8,10,15H2,(H,16,17).
What are the key properties of 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide?
3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide has a molecular weight of 276.29 g/mol, XLogP of 1.48, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-2-ylmethoxy)ethoxy]benzohydrazide is sourced from PubChem (CID 63587007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).