8-ethoxyquinoline-5-carbohydrazide

C12H13N3O2 — CID 84613958

IUPAC8-ethoxyquinoline-5-carbohydrazide
SMILESCCOc1ccc(C(=O)NN)c2cccnc12
InChIInChI=1S/C12H13N3O2/c1-2-17-10-6-5-9(12(16)15-13)8-4-3-7-14-11(8)10/h3-7H,2,13H2,1H3,(H,15,16)
InChIKeyJIIWWLWRBCVREC-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.24
Rot. Bonds3

About 8-ethoxyquinoline-5-carbohydrazide

8-ethoxyquinoline-5-carbohydrazide (PubChem CID 84613958) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 8-ethoxyquinoline-5-carbohydrazide.

Molecular Properties

Compound Name8-ethoxyquinoline-5-carbohydrazide
PubChem CID84613958
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name8-ethoxyquinoline-5-carbohydrazide
SMILESCCOc1ccc(C(=O)NN)c2cccnc12
InChIInChI=1S/C12H13N3O2/c1-2-17-10-6-5-9(12(16)15-13)8-4-3-7-14-11(8)10/h3-7H,2,13H2,1H3,(H,15,16)
InChIKeyJIIWWLWRBCVREC-UHFFFAOYSA-N
XLogP1.24
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.24
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'}

Analyze 8-ethoxyquinoline-5-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 8-butoxyquinoline-5-carboxylate
CID 96709879
5-bromo-8-ethoxyquinoline
CID 100612531
1-(8-ethoxyquinolin-5-yl)ethanol
CID 82264789
ethyl 2-[(8-methoxyquinoline-5-carbonyl)-methylamino]acetate
CID 10470169
2-[(8-ethoxyquinolin-5-yl)sulfonylamino]benzamide
CID 25035028
8-Ethoxy-5-quinolinesulfonic acid sodium salt monohydrate
CID 45157436
2-(5-iodoquinolin-8-yl)oxyacetohydrazide
CID 100613197
methyl 3-(8-methoxyquinolin-5-yl)-2-methyl-3-oxopropanoate
CID 59335917
4-(8-ethoxyquinolin-5-yl)butan-1-amine
CID 117362958
(2R)-N-(8-ethoxyquinolin-5-yl)-2-methoxy-2-methylpentanamide
CID 100774530
CID 20678160
CID 20678160
ethyl 3-(5-nitroquinolin-8-yl)oxypropanoate
CID 60865673

Frequently Asked Questions

What is the IUPAC name of 8-ethoxyquinoline-5-carbohydrazide?
The IUPAC name of 8-ethoxyquinoline-5-carbohydrazide (CID 84613958) is 8-ethoxyquinoline-5-carbohydrazide.
What is the SMILES notation for 8-ethoxyquinoline-5-carbohydrazide?
The canonical SMILES for 8-ethoxyquinoline-5-carbohydrazide is CCOc1ccc(C(=O)NN)c2cccnc12.
What is the InChIKey of 8-ethoxyquinoline-5-carbohydrazide?
The InChIKey is JIIWWLWRBCVREC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-2-17-10-6-5-9(12(16)15-13)8-4-3-7-14-11(8)10/h3-7H,2,13H2,1H3,(H,15,16).
What are the key properties of 8-ethoxyquinoline-5-carbohydrazide?
8-ethoxyquinoline-5-carbohydrazide has a molecular weight of 231.25 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethoxyquinoline-5-carbohydrazide is sourced from PubChem (CID 84613958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).