(2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine

C12H14FN3O — CID 62251914

IUPAC(2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine
SMILESCCc1cc(NN)c2cc(F)cc(OC)c2n1
InChIInChI=1S/C12H14FN3O/c1-3-8-6-10(16-14)9-4-7(13)5-11(17-2)12(9)15-8/h4-6H,3,14H2,1-2H3,(H,15,16)
InChIKeyYMSFPTFFGKJDSI-UHFFFAOYSA-N
MW235.26 g/mol
LogP2.23
Rot. Bonds3

About (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine

(2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine (PubChem CID 62251914) has the molecular formula C12H14FN3O and a molecular weight of 235.26 g/mol. Its IUPAC name is (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine
PubChem CID62251914
Molecular FormulaC12H14FN3O
Molecular Weight235.26 g/mol
Exact Mass235.11
IUPAC Name(2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine
SMILESCCc1cc(NN)c2cc(F)cc(OC)c2n1
InChIInChI=1S/C12H14FN3O/c1-3-8-6-10(16-14)9-4-7(13)5-11(17-2)12(9)15-8/h4-6H,3,14H2,1-2H3,(H,15,16)
InChIKeyYMSFPTFFGKJDSI-UHFFFAOYSA-N
XLogP2.23
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.26
LogP ≤ 52.23
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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Frequently Asked Questions

What is the IUPAC name of (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine?
The IUPAC name of (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine (CID 62251914) is (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine.
What is the SMILES notation for (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine?
The canonical SMILES for (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine is CCc1cc(NN)c2cc(F)cc(OC)c2n1.
What is the InChIKey of (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine?
The InChIKey is YMSFPTFFGKJDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3O/c1-3-8-6-10(16-14)9-4-7(13)5-11(17-2)12(9)15-8/h4-6H,3,14H2,1-2H3,(H,15,16).
What are the key properties of (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine?
(2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine has a molecular weight of 235.26 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-6-fluoro-8-methoxyquinolin-4-yl)hydrazine is sourced from PubChem (CID 62251914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).