[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine

C11H11Br2N3O — CID 62318850

IUPAC[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine
SMILESCOCc1cc(NN)c2cc(Br)cc(Br)c2n1
InChIInChI=1S/C11H11Br2N3O/c1-17-5-7-4-10(16-14)8-2-6(12)3-9(13)11(8)15-7/h2-4H,5,14H2,1H3,(H,15,16)
InChIKeyIYXIHHPUJDHPBD-UHFFFAOYSA-N
MW361.04 g/mol
LogP3.19
Rot. Bonds3

About [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine

[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine (PubChem CID 62318850) has the molecular formula C11H11Br2N3O and a molecular weight of 361.04 g/mol. Its IUPAC name is [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine.

Molecular Properties

Compound Name[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine
PubChem CID62318850
Molecular FormulaC11H11Br2N3O
Molecular Weight361.04 g/mol
Exact Mass358.93
IUPAC Name[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine
SMILESCOCc1cc(NN)c2cc(Br)cc(Br)c2n1
InChIInChI=1S/C11H11Br2N3O/c1-17-5-7-4-10(16-14)8-2-6(12)3-9(13)11(8)15-7/h2-4H,5,14H2,1H3,(H,15,16)
InChIKeyIYXIHHPUJDHPBD-UHFFFAOYSA-N
XLogP3.19
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.04
LogP ≤ 53.19
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

6-bromo-N-ethyl-8-fluoro-2-(methoxymethyl)quinolin-4-amine
CID 55062205
[6,7-Difluoro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62318292
5-Bromo-8-fluoro-2-(methoxymethyl)quinolin-4-amine
CID 62318408
[5-Fluoro-2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine
CID 62318479
[7,8-Difluoro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62318480
[7-Fluoro-2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine
CID 62318482
[5,7-Difluoro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62318659
[6-Fluoro-2-(methoxymethyl)-8-methylquinolin-4-yl]hydrazine
CID 62318663
[8-Fluoro-2-(methoxymethyl)-6-methylquinolin-4-yl]hydrazine
CID 62318665
[6-Fluoro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62318848
[5-Bromo-8-fluoro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62319017
[8-Fluoro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62319206

Frequently Asked Questions

What is the IUPAC name of [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine?
The IUPAC name of [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine (CID 62318850) is [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine.
What is the SMILES notation for [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine?
The canonical SMILES for [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine is COCc1cc(NN)c2cc(Br)cc(Br)c2n1.
What is the InChIKey of [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine?
The InChIKey is IYXIHHPUJDHPBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Br2N3O/c1-17-5-7-4-10(16-14)8-2-6(12)3-9(13)11(8)15-7/h2-4H,5,14H2,1H3,(H,15,16).
What are the key properties of [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine?
[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine has a molecular weight of 361.04 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine is sourced from PubChem (CID 62318850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).