2-quinolin-8-yloxybutanehydrazide

C13H15N3O2 — CID 63575214

IUPAC2-quinolin-8-yloxybutanehydrazide
SMILESCCC(Oc1cccc2cccnc12)C(=O)NN
InChIInChI=1S/C13H15N3O2/c1-2-10(13(17)16-14)18-11-7-3-5-9-6-4-8-15-12(9)11/h3-8,10H,2,14H2,1H3,(H,16,17)
InChIKeySEZUQYCJKZSRIN-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.38
Rot. Bonds4

About 2-quinolin-8-yloxybutanehydrazide

2-quinolin-8-yloxybutanehydrazide (PubChem CID 63575214) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-quinolin-8-yloxybutanehydrazide.

Molecular Properties

Compound Name2-quinolin-8-yloxybutanehydrazide
PubChem CID63575214
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-quinolin-8-yloxybutanehydrazide
SMILESCCC(Oc1cccc2cccnc12)C(=O)NN
InChIInChI=1S/C13H15N3O2/c1-2-10(13(17)16-14)18-11-7-3-5-9-6-4-8-15-12(9)11/h3-8,10H,2,14H2,1H3,(H,16,17)
InChIKeySEZUQYCJKZSRIN-UHFFFAOYSA-N
XLogP1.38
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.38
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 2-quinolin-8-yloxybutanehydrazide 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

2-quinolin-8-yloxybutanamide
CID 62901439
2-[(2-nitro-3-pyridinyl)oxy]butanehydrazide
CID 55213215
8-[(2S)-butan-2-yl]oxyquinoline
CID 99646584
2-quinolin-8-yloxypentan-3-one
CID 64868229
2-(2-nitrophenoxy)butanehydrazide
CID 54792980
quinolin-8-yl 2-ethylhexanoate
CID 163430049
2-amino-2-methyl-4-quinolin-8-yloxypentanamide
CID 64706156
(2R)-N-methyl-2-naphthalen-1-yloxybutanamide
CID 30388203
N-(furan-2-ylmethyl)-2-quinolin-8-yloxypropanamide
CID 4781245
(2S)-N-ethyl-2-naphthalen-1-yloxybutanamide
CID 92675039
2-(3-propan-2-ylphenoxy)butanehydrazide
CID 55213791
2-hydrazinyl-2-oxo-N-(quinolin-8-ylmethyl)acetamide
CID 69377520

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-8-yloxybutanehydrazide?
The IUPAC name of 2-quinolin-8-yloxybutanehydrazide (CID 63575214) is 2-quinolin-8-yloxybutanehydrazide.
What is the SMILES notation for 2-quinolin-8-yloxybutanehydrazide?
The canonical SMILES for 2-quinolin-8-yloxybutanehydrazide is CCC(Oc1cccc2cccnc12)C(=O)NN.
What is the InChIKey of 2-quinolin-8-yloxybutanehydrazide?
The InChIKey is SEZUQYCJKZSRIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-2-10(13(17)16-14)18-11-7-3-5-9-6-4-8-15-12(9)11/h3-8,10H,2,14H2,1H3,(H,16,17).
What are the key properties of 2-quinolin-8-yloxybutanehydrazide?
2-quinolin-8-yloxybutanehydrazide has a molecular weight of 245.28 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-8-yloxybutanehydrazide is sourced from PubChem (CID 63575214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).