5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide

C16H14N2O3 — CID 3791373

IUPAC5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide
SMILESNNC(=O)c1ccc(COc2cccc3ccccc23)o1
InChIInChI=1S/C16H14N2O3/c17-18-16(19)15-9-8-12(21-15)10-20-14-7-3-5-11-4-1-2-6-13(11)14/h1-9H,10,17H2,(H,18,19)
InChIKeyINRJOWNKUHJAAP-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.62
Rot. Bonds4

About 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide

5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide (PubChem CID 3791373) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide.

Molecular Properties

Compound Name5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide
PubChem CID3791373
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide
SMILESNNC(=O)c1ccc(COc2cccc3ccccc23)o1
InChIInChI=1S/C16H14N2O3/c17-18-16(19)15-9-8-12(21-15)10-20-14-7-3-5-11-4-1-2-6-13(11)14/h1-9H,10,17H2,(H,18,19)
InChIKeyINRJOWNKUHJAAP-UHFFFAOYSA-N
XLogP2.62
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide?
The IUPAC name of 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide (CID 3791373) is 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide.
What is the SMILES notation for 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide?
The canonical SMILES for 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide is NNC(=O)c1ccc(COc2cccc3ccccc23)o1.
What is the InChIKey of 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide?
The InChIKey is INRJOWNKUHJAAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c17-18-16(19)15-9-8-12(21-15)10-20-14-7-3-5-11-4-1-2-6-13(11)14/h1-9H,10,17H2,(H,18,19).
What are the key properties of 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide?
5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide has a molecular weight of 282.30 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(naphthalen-1-yloxymethyl)furan-2-carbohydrazide is sourced from PubChem (CID 3791373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).