[1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine

C11H18BrN3O — CID 105245333

IUPAC[1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
SMILESCOC(C)(C)C(Cc1ccc(Br)cn1)NN
InChIInChI=1S/C11H18BrN3O/c1-11(2,16-3)10(15-13)6-9-5-4-8(12)7-14-9/h4-5,7,10,15H,6,13H2,1-3H3
InChIKeyWNLXCJZOTVNAHL-UHFFFAOYSA-N
MW288.19 g/mol
LogP1.64
Rot. Bonds5

About [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine

[1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine (PubChem CID 105245333) has the molecular formula C11H18BrN3O and a molecular weight of 288.19 g/mol. Its IUPAC name is [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
PubChem CID105245333
Molecular FormulaC11H18BrN3O
Molecular Weight288.19 g/mol
Exact Mass287.06
IUPAC Name[1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
SMILESCOC(C)(C)C(Cc1ccc(Br)cn1)NN
InChIInChI=1S/C11H18BrN3O/c1-11(2,16-3)10(15-13)6-9-5-4-8(12)7-14-9/h4-5,7,10,15H,6,13H2,1-3H3
InChIKeyWNLXCJZOTVNAHL-UHFFFAOYSA-N
XLogP1.64
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.19
LogP ≤ 51.64
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

[1-(5-bromo-2-pyridinyl)-3-methyl-3-methylsulfonylbutan-2-yl]hydrazine
CID 105334662
[1-(5-bromo-2-pyridinyl)-3-methoxypropan-2-yl]hydrazine
CID 105207194
3-(5-bromo-2-pyridinyl)-1,1,1-trifluoro-N-methylpropan-2-amine
CID 105036466
[1-(5-bromo-2-pyridinyl)-3-methylbutan-2-yl]hydrazine
CID 105199530
[1-(5-bromo-2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 105245363
1-(5-bromo-2-pyridinyl)-3-ethyl-3-methoxypentan-2-amine
CID 116760732
[1-(5-bromo-2-pyridinyl)-3-methoxypentan-2-yl]hydrazine
CID 105270656
[1-(5-ethyl-2-pyridinyl)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274346
[1-(5-bromo-2-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105267672
1-(5-bromo-2-pyridinyl)-N-ethyl-3-methyl-3-phenylbutan-2-amine
CID 104801951
5-bromo-2-[2-(chloromethyl)-3,3-dimethylbutyl]pyridine
CID 104813393
1,2-bis(5-bromo-2-pyridinyl)-N-methylethanamine
CID 104804023

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
The IUPAC name of [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine (CID 105245333) is [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine is COC(C)(C)C(Cc1ccc(Br)cn1)NN.
What is the InChIKey of [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
The InChIKey is WNLXCJZOTVNAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrN3O/c1-11(2,16-3)10(15-13)6-9-5-4-8(12)7-14-9/h4-5,7,10,15H,6,13H2,1-3H3.
What are the key properties of [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
[1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine has a molecular weight of 288.19 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-2-pyridinyl)-3-methoxy-3-methylbutan-2-yl]hydrazine is sourced from PubChem (CID 105245333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).