[1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine

C12H17Br2N3O — CID 105268360

IUPAC[1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine
SMILESNNC(CCC1CCCO1)c1ncc(Br)cc1Br
InChIInChI=1S/C12H17Br2N3O/c13-8-6-10(14)12(16-7-8)11(17-15)4-3-9-2-1-5-18-9/h6-7,9,11,17H,1-5,15H2
InChIKeyAFORPQKBZJBRHB-UHFFFAOYSA-N
MW379.10 g/mol
LogP3.07
Rot. Bonds5

About [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine

[1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine (PubChem CID 105268360) has the molecular formula C12H17Br2N3O and a molecular weight of 379.10 g/mol. Its IUPAC name is [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine
PubChem CID105268360
Molecular FormulaC12H17Br2N3O
Molecular Weight379.10 g/mol
Exact Mass376.97
IUPAC Name[1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine
SMILESNNC(CCC1CCCO1)c1ncc(Br)cc1Br
InChIInChI=1S/C12H17Br2N3O/c13-8-6-10(14)12(16-7-8)11(17-15)4-3-9-2-1-5-18-9/h6-7,9,11,17H,1-5,15H2
InChIKeyAFORPQKBZJBRHB-UHFFFAOYSA-N
XLogP3.07
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.10
LogP ≤ 53.07
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

[3-cyclopropyl-1-(3,5-dibromo-2-pyridinyl)propyl]hydrazine
CID 105268447
[2-cyclopropyl-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine
CID 105268257
[1-(3-bromo-5-fluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105238607
[3-(oxolan-2-yl)-1-pyrimidin-5-ylpropyl]hydrazine
CID 105292141
[1-(6-chloro-3-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105253010
[1-(5-bromo-2-pyridinyl)-4-(oxolan-2-yl)butan-2-yl]hydrazine
CID 105334555
[1-(3,5-dibromophenyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 114023446
[1-(3-bromothiophen-2-yl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314337
[1-(3-bromo-2-chlorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314342
[1-(5-bromo-2-pyridinyl)-4-(oxan-2-yl)butan-2-yl]hydrazine
CID 105334479
[1-(3,5-dibromo-2-pyridinyl)-5-methylhexyl]hydrazine
CID 105268552
[1-(4-bromothiophen-2-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105222541

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine?
The IUPAC name of [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine (CID 105268360) is [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine.
What is the SMILES notation for [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine?
The canonical SMILES for [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine is NNC(CCC1CCCO1)c1ncc(Br)cc1Br.
What is the InChIKey of [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine?
The InChIKey is AFORPQKBZJBRHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17Br2N3O/c13-8-6-10(14)12(16-7-8)11(17-15)4-3-9-2-1-5-18-9/h6-7,9,11,17H,1-5,15H2.
What are the key properties of [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine?
[1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine has a molecular weight of 379.10 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-dibromo-2-pyridinyl)-3-(oxolan-2-yl)propyl]hydrazine is sourced from PubChem (CID 105268360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).