[(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine

C16H14BrN3 — CID 105198115

IUPAC[(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine
SMILESNNC(c1cccc(Br)c1)c1ccc2ncccc2c1
InChIInChI=1S/C16H14BrN3/c17-14-5-1-3-12(10-14)16(20-18)13-6-7-15-11(9-13)4-2-8-19-15/h1-10,16,20H,18H2
InChIKeyRZNRCPOCLMNLEH-UHFFFAOYSA-N
MW328.21 g/mol
LogP3.55
Rot. Bonds3

About [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine

[(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine (PubChem CID 105198115) has the molecular formula C16H14BrN3 and a molecular weight of 328.21 g/mol. Its IUPAC name is [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine
PubChem CID105198115
Molecular FormulaC16H14BrN3
Molecular Weight328.21 g/mol
Exact Mass327.04
IUPAC Name[(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine
SMILESNNC(c1cccc(Br)c1)c1ccc2ncccc2c1
InChIInChI=1S/C16H14BrN3/c17-14-5-1-3-12(10-14)16(20-18)13-6-7-15-11(9-13)4-2-8-19-15/h1-10,16,20H,18H2
InChIKeyRZNRCPOCLMNLEH-UHFFFAOYSA-N
XLogP3.55
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.21
LogP ≤ 53.55
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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Related Compounds

[(4-bromo-2-methylphenyl)-quinolin-6-ylmethyl]hydrazine
CID 105327263
[(4-bromo-2-fluorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 105281033
[(4-fluorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 105192827
[(2-bromo-6-fluorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 105280520
[(3-bromo-2-fluorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 106648882
[(3-bromo-2-chlorophenyl)-quinolin-6-ylmethyl]hydrazine
CID 105327335
[(3-chloro-4-methylphenyl)-quinolin-6-ylmethyl]hydrazine
CID 105327312
[(3-fluoro-2-pyridinyl)-quinolin-6-ylmethyl]hydrazine
CID 105257952
[(2,5-dichlorothiophen-3-yl)-quinolin-6-ylmethyl]hydrazine
CID 107970510
[(2-methyl-1,3-thiazol-5-yl)-quinolin-6-ylmethyl]hydrazine
CID 114031832
[(3-fluoro-4-pyridinyl)-quinolin-6-ylmethyl]hydrazine
CID 105218542
[(3-bromo-4-methylphenyl)-quinolin-7-ylmethyl]hydrazine
CID 105327512

Frequently Asked Questions

What is the IUPAC name of [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine?
The IUPAC name of [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine (CID 105198115) is [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine.
What is the SMILES notation for [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine?
The canonical SMILES for [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine is NNC(c1cccc(Br)c1)c1ccc2ncccc2c1.
What is the InChIKey of [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine?
The InChIKey is RZNRCPOCLMNLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrN3/c17-14-5-1-3-12(10-14)16(20-18)13-6-7-15-11(9-13)4-2-8-19-15/h1-10,16,20H,18H2.
What are the key properties of [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine?
[(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine has a molecular weight of 328.21 g/mol, XLogP of 3.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromophenyl)-quinolin-6-ylmethyl]hydrazine is sourced from PubChem (CID 105198115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).