1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine

C10H16BrN3 — CID 105202011

IUPAC1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine
SMILESCCCC(Cc1cncc(Br)c1)NN
InChIInChI=1S/C10H16BrN3/c1-2-3-10(14-12)5-8-4-9(11)7-13-6-8/h4,6-7,10,14H,2-3,5,12H2,1H3
InChIKeyGXJUGTRZIGIPJN-UHFFFAOYSA-N
MW258.16 g/mol
LogP2.02
Rot. Bonds5

About 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine

1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine (PubChem CID 105202011) has the molecular formula C10H16BrN3 and a molecular weight of 258.16 g/mol. Its IUPAC name is 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine.

Molecular Properties

Compound Name1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine
PubChem CID105202011
Molecular FormulaC10H16BrN3
Molecular Weight258.16 g/mol
Exact Mass257.05
IUPAC Name1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine
SMILESCCCC(Cc1cncc(Br)c1)NN
InChIInChI=1S/C10H16BrN3/c1-2-3-10(14-12)5-8-4-9(11)7-13-6-8/h4,6-7,10,14H,2-3,5,12H2,1H3
InChIKeyGXJUGTRZIGIPJN-UHFFFAOYSA-N
XLogP2.02
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.16
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine?
The IUPAC name of 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine (CID 105202011) is 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine.
What is the SMILES notation for 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine?
The canonical SMILES for 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine is CCCC(Cc1cncc(Br)c1)NN.
What is the InChIKey of 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine?
The InChIKey is GXJUGTRZIGIPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrN3/c1-2-3-10(14-12)5-8-4-9(11)7-13-6-8/h4,6-7,10,14H,2-3,5,12H2,1H3.
What are the key properties of 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine?
1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine has a molecular weight of 258.16 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-pyridinyl)pentan-2-ylhydrazine is sourced from PubChem (CID 105202011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).