N'-(2-quinolin-8-ylacetyl)benzohydrazide

C18H15N3O2 — CID 24663185

IUPACN'-(2-quinolin-8-ylacetyl)benzohydrazide
SMILESO=C(Cc1cccc2cccnc12)NNC(=O)c1ccccc1
InChIInChI=1S/C18H15N3O2/c22-16(20-21-18(23)14-6-2-1-3-7-14)12-15-9-4-8-13-10-5-11-19-17(13)15/h1-11H,12H2,(H,20,22)(H,21,23)
InChIKeyKJPGMOPFODTNKK-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.24
Rot. Bonds3

About N'-(2-quinolin-8-ylacetyl)benzohydrazide

N'-(2-quinolin-8-ylacetyl)benzohydrazide (PubChem CID 24663185) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is N'-(2-quinolin-8-ylacetyl)benzohydrazide.

Molecular Properties

Compound NameN'-(2-quinolin-8-ylacetyl)benzohydrazide
PubChem CID24663185
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC NameN'-(2-quinolin-8-ylacetyl)benzohydrazide
SMILESO=C(Cc1cccc2cccnc12)NNC(=O)c1ccccc1
InChIInChI=1S/C18H15N3O2/c22-16(20-21-18(23)14-6-2-1-3-7-14)12-15-9-4-8-13-10-5-11-19-17(13)15/h1-11H,12H2,(H,20,22)(H,21,23)
InChIKeyKJPGMOPFODTNKK-UHFFFAOYSA-N
XLogP2.24
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-quinolin-8-ylacetyl)benzohydrazide?
The IUPAC name of N'-(2-quinolin-8-ylacetyl)benzohydrazide (CID 24663185) is N'-(2-quinolin-8-ylacetyl)benzohydrazide.
What is the SMILES notation for N'-(2-quinolin-8-ylacetyl)benzohydrazide?
The canonical SMILES for N'-(2-quinolin-8-ylacetyl)benzohydrazide is O=C(Cc1cccc2cccnc12)NNC(=O)c1ccccc1.
What is the InChIKey of N'-(2-quinolin-8-ylacetyl)benzohydrazide?
The InChIKey is KJPGMOPFODTNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-16(20-21-18(23)14-6-2-1-3-7-14)12-15-9-4-8-13-10-5-11-19-17(13)15/h1-11H,12H2,(H,20,22)(H,21,23).
What are the key properties of N'-(2-quinolin-8-ylacetyl)benzohydrazide?
N'-(2-quinolin-8-ylacetyl)benzohydrazide has a molecular weight of 305.34 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-quinolin-8-ylacetyl)benzohydrazide is sourced from PubChem (CID 24663185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).