(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine

C12H14BrN3O — CID 63233442

IUPAC(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine
SMILESCCc1cc2c(Br)ccc(OC)c2nc1NN
InChIInChI=1S/C12H14BrN3O/c1-3-7-6-8-9(13)4-5-10(17-2)11(8)15-12(7)16-14/h4-6H,3,14H2,1-2H3,(H,15,16)
InChIKeyWBXOKPOSZDROCB-UHFFFAOYSA-N
MW296.17 g/mol
LogP2.85
Rot. Bonds3

About (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine

(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine (PubChem CID 63233442) has the molecular formula C12H14BrN3O and a molecular weight of 296.17 g/mol. Its IUPAC name is (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine.

Molecular Properties

Compound Name(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine
PubChem CID63233442
Molecular FormulaC12H14BrN3O
Molecular Weight296.17 g/mol
Exact Mass295.03
IUPAC Name(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine
SMILESCCc1cc2c(Br)ccc(OC)c2nc1NN
InChIInChI=1S/C12H14BrN3O/c1-3-7-6-8-9(13)4-5-10(17-2)11(8)15-12(7)16-14/h4-6H,3,14H2,1-2H3,(H,15,16)
InChIKeyWBXOKPOSZDROCB-UHFFFAOYSA-N
XLogP2.85
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.17
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-bromo-3-ethyl-8-methoxy-N-propylquinolin-2-amine
CID 63525615
5-bromo-8-methoxy-3-propylquinolin-2-amine
CID 63232444
(3-ethyl-5,7-dimethoxyquinolin-2-yl)hydrazine
CID 63233121
3-ethyl-5,8-dimethoxy-N-propylquinolin-2-amine
CID 63524526
5-chloro-3-ethyl-8-methoxy-N-methylquinolin-2-amine
CID 63232251
(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine
CID 63233439
(8-bromo-5-chloro-3-ethyl-6-methylquinolin-2-yl)hydrazine
CID 104725289
(8-chloro-5-methoxy-3-propylquinolin-2-yl)hydrazine
CID 63233166
(3-ethyl-5,8-dimethylquinolin-2-yl)hydrazine;hydrochloride
CID 43866124
5-bromo-8-methoxy-3-propan-2-ylquinolin-2-amine
CID 63232490
(3-ethyl-8-fluoro-5-methylquinolin-2-yl)hydrazine
CID 63232243
(3-ethyl-5-fluoro-8-methylquinolin-2-yl)hydrazine
CID 63232655

Frequently Asked Questions

What is the IUPAC name of (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine?
The IUPAC name of (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine (CID 63233442) is (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine.
What is the SMILES notation for (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine?
The canonical SMILES for (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine is CCc1cc2c(Br)ccc(OC)c2nc1NN.
What is the InChIKey of (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine?
The InChIKey is WBXOKPOSZDROCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3O/c1-3-7-6-8-9(13)4-5-10(17-2)11(8)15-12(7)16-14/h4-6H,3,14H2,1-2H3,(H,15,16).
What are the key properties of (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine?
(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine has a molecular weight of 296.17 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine is sourced from PubChem (CID 63233442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).