[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine

C12H13BrN4 — CID 105251101

IUPAC[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1cncc(C(NN)c2cncc(Br)c2)c1
InChIInChI=1S/C12H13BrN4/c1-8-2-9(5-15-4-8)12(17-14)10-3-11(13)7-16-6-10/h2-7,12,17H,14H2,1H3
InChIKeyRAPOGCQJRLXINL-UHFFFAOYSA-N
MW293.17 g/mol
LogP2.10
Rot. Bonds3

About [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine

[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine (PubChem CID 105251101) has the molecular formula C12H13BrN4 and a molecular weight of 293.17 g/mol. Its IUPAC name is [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
PubChem CID105251101
Molecular FormulaC12H13BrN4
Molecular Weight293.17 g/mol
Exact Mass292.03
IUPAC Name[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1cncc(C(NN)c2cncc(Br)c2)c1
InChIInChI=1S/C12H13BrN4/c1-8-2-9(5-15-4-8)12(17-14)10-3-11(13)7-16-6-10/h2-7,12,17H,14H2,1H3
InChIKeyRAPOGCQJRLXINL-UHFFFAOYSA-N
XLogP2.10
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.17
LogP ≤ 52.10
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 [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine (CID 105251101) is [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine is Cc1cncc(C(NN)c2cncc(Br)c2)c1.
What is the InChIKey of [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The InChIKey is RAPOGCQJRLXINL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN4/c1-8-2-9(5-15-4-8)12(17-14)10-3-11(13)7-16-6-10/h2-7,12,17H,14H2,1H3.
What are the key properties of [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
[(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine has a molecular weight of 293.17 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-3-pyridinyl)-(5-methyl-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105251101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).