4-(quinolin-8-yloxymethyl)benzohydrazide

C17H15N3O2 — CID 2376875

IUPAC4-(quinolin-8-yloxymethyl)benzohydrazide
SMILESNNC(=O)c1ccc(COc2cccc3cccnc23)cc1
InChIInChI=1S/C17H15N3O2/c18-20-17(21)14-8-6-12(7-9-14)11-22-15-5-1-3-13-4-2-10-19-16(13)15/h1-10H,11,18H2,(H,20,21)
InChIKeyGZEPGQARAYQUPR-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.42
Rot. Bonds4

About 4-(quinolin-8-yloxymethyl)benzohydrazide

4-(quinolin-8-yloxymethyl)benzohydrazide (PubChem CID 2376875) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-(quinolin-8-yloxymethyl)benzohydrazide.

Molecular Properties

Compound Name4-(quinolin-8-yloxymethyl)benzohydrazide
PubChem CID2376875
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name4-(quinolin-8-yloxymethyl)benzohydrazide
SMILESNNC(=O)c1ccc(COc2cccc3cccnc23)cc1
InChIInChI=1S/C17H15N3O2/c18-20-17(21)14-8-6-12(7-9-14)11-22-15-5-1-3-13-4-2-10-19-16(13)15/h1-10H,11,18H2,(H,20,21)
InChIKeyGZEPGQARAYQUPR-UHFFFAOYSA-N
XLogP2.42
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.42
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 4-(quinolin-8-yloxymethyl)benzohydrazide?
The IUPAC name of 4-(quinolin-8-yloxymethyl)benzohydrazide (CID 2376875) is 4-(quinolin-8-yloxymethyl)benzohydrazide.
What is the SMILES notation for 4-(quinolin-8-yloxymethyl)benzohydrazide?
The canonical SMILES for 4-(quinolin-8-yloxymethyl)benzohydrazide is NNC(=O)c1ccc(COc2cccc3cccnc23)cc1.
What is the InChIKey of 4-(quinolin-8-yloxymethyl)benzohydrazide?
The InChIKey is GZEPGQARAYQUPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c18-20-17(21)14-8-6-12(7-9-14)11-22-15-5-1-3-13-4-2-10-19-16(13)15/h1-10H,11,18H2,(H,20,21).
What are the key properties of 4-(quinolin-8-yloxymethyl)benzohydrazide?
4-(quinolin-8-yloxymethyl)benzohydrazide has a molecular weight of 293.33 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(quinolin-8-yloxymethyl)benzohydrazide is sourced from PubChem (CID 2376875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).