[(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine

C16H15BrN4 — CID 105268086

IUPAC[(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine
SMILESCc1ccc2cc(C(NN)c3ncccc3Br)ccc2n1
InChIInChI=1S/C16H15BrN4/c1-10-4-5-11-9-12(6-7-14(11)20-10)15(21-18)16-13(17)3-2-8-19-16/h2-9,15,21H,18H2,1H3
InChIKeyXTGNOSAKLQATSN-UHFFFAOYSA-N
MW343.23 g/mol
LogP3.25
Rot. Bonds3

About [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine

[(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine (PubChem CID 105268086) has the molecular formula C16H15BrN4 and a molecular weight of 343.23 g/mol. Its IUPAC name is [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine
PubChem CID105268086
Molecular FormulaC16H15BrN4
Molecular Weight343.23 g/mol
Exact Mass342.05
IUPAC Name[(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine
SMILESCc1ccc2cc(C(NN)c3ncccc3Br)ccc2n1
InChIInChI=1S/C16H15BrN4/c1-10-4-5-11-9-12(6-7-14(11)20-10)15(21-18)16-13(17)3-2-8-19-16/h2-9,15,21H,18H2,1H3
InChIKeyXTGNOSAKLQATSN-UHFFFAOYSA-N
XLogP3.25
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.23
LogP ≤ 53.25
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-bromo-2-pyridinyl)-(3-methylphenyl)methyl]hydrazine
CID 105268060
[(3-bromo-2-pyridinyl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 107130883
[(3-bromo-2-pyridinyl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 107562462
[(3-fluorophenyl)-(2-methylquinolin-6-yl)methyl]hydrazine
CID 105193028
[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine
CID 105327229
[(3-fluoro-2-pyridinyl)-quinolin-6-ylmethyl]hydrazine
CID 105257952
[(2-methylquinolin-6-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105327200
[(3-bromo-2-fluorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 106648882
[(2-bromo-6-fluorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 105280520
[(2-methylquinolin-6-yl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105327190
[(3-bromo-4-methylphenyl)-quinolin-7-ylmethyl]hydrazine
CID 105327512
[(3-bromo-2-chlorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 105327335

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine?
The IUPAC name of [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine (CID 105268086) is [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine is Cc1ccc2cc(C(NN)c3ncccc3Br)ccc2n1.
What is the InChIKey of [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine?
The InChIKey is XTGNOSAKLQATSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrN4/c1-10-4-5-11-9-12(6-7-14(11)20-10)15(21-18)16-13(17)3-2-8-19-16/h2-9,15,21H,18H2,1H3.
What are the key properties of [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine?
[(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine has a molecular weight of 343.23 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-2-pyridinyl)-(2-methylquinolin-6-yl)methyl]hydrazine is sourced from PubChem (CID 105268086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).