2-hydroxy-N'-quinolin-2-ylbenzohydrazide

C16H13N3O2 — CID 58876908

IUPAC2-hydroxy-N'-quinolin-2-ylbenzohydrazide
SMILESO=C(NNc1ccc2ccccc2n1)c1ccccc1O
InChIInChI=1S/C16H13N3O2/c20-14-8-4-2-6-12(14)16(21)19-18-15-10-9-11-5-1-3-7-13(11)17-15/h1-10,20H,(H,17,18)(H,19,21)
InChIKeyMLPDYMMVULYGRF-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.70
Rot. Bonds3

About 2-hydroxy-N'-quinolin-2-ylbenzohydrazide

2-hydroxy-N'-quinolin-2-ylbenzohydrazide (PubChem CID 58876908) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 2-hydroxy-N'-quinolin-2-ylbenzohydrazide.

Molecular Properties

Compound Name2-hydroxy-N'-quinolin-2-ylbenzohydrazide
PubChem CID58876908
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name2-hydroxy-N'-quinolin-2-ylbenzohydrazide
SMILESO=C(NNc1ccc2ccccc2n1)c1ccccc1O
InChIInChI=1S/C16H13N3O2/c20-14-8-4-2-6-12(14)16(21)19-18-15-10-9-11-5-1-3-7-13(11)17-15/h1-10,20H,(H,17,18)(H,19,21)
InChIKeyMLPDYMMVULYGRF-UHFFFAOYSA-N
XLogP2.70
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 2-hydroxy-N'-quinolin-2-ylbenzohydrazide?
The IUPAC name of 2-hydroxy-N'-quinolin-2-ylbenzohydrazide (CID 58876908) is 2-hydroxy-N'-quinolin-2-ylbenzohydrazide.
What is the SMILES notation for 2-hydroxy-N'-quinolin-2-ylbenzohydrazide?
The canonical SMILES for 2-hydroxy-N'-quinolin-2-ylbenzohydrazide is O=C(NNc1ccc2ccccc2n1)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N'-quinolin-2-ylbenzohydrazide?
The InChIKey is MLPDYMMVULYGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c20-14-8-4-2-6-12(14)16(21)19-18-15-10-9-11-5-1-3-7-13(11)17-15/h1-10,20H,(H,17,18)(H,19,21).
What are the key properties of 2-hydroxy-N'-quinolin-2-ylbenzohydrazide?
2-hydroxy-N'-quinolin-2-ylbenzohydrazide has a molecular weight of 279.30 g/mol, XLogP of 2.70, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N'-quinolin-2-ylbenzohydrazide is sourced from PubChem (CID 58876908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).