[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine

C16H14BrN3 — CID 105208734

IUPAC[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine
SMILESNNC(c1ccccc1Br)c1cccc2ncccc12
InChIInChI=1S/C16H14BrN3/c17-14-8-2-1-5-13(14)16(20-18)12-6-3-9-15-11(12)7-4-10-19-15/h1-10,16,20H,18H2
InChIKeyXIHOLWKCQXRODB-UHFFFAOYSA-N
MW328.21 g/mol
LogP3.55
Rot. Bonds3

About [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine

[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine (PubChem CID 105208734) has the molecular formula C16H14BrN3 and a molecular weight of 328.21 g/mol. Its IUPAC name is [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine
PubChem CID105208734
Molecular FormulaC16H14BrN3
Molecular Weight328.21 g/mol
Exact Mass327.04
IUPAC Name[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine
SMILESNNC(c1ccccc1Br)c1cccc2ncccc12
InChIInChI=1S/C16H14BrN3/c17-14-8-2-1-5-13(14)16(20-18)12-6-3-9-15-11(12)7-4-10-19-15/h1-10,16,20H,18H2
InChIKeyXIHOLWKCQXRODB-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

[(2-iodophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326944
[phenyl(quinolin-5-yl)methyl]hydrazine
CID 105199350
[(2-bromo-3-fluorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326935
[(4-bromo-3-fluorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326969
[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326912
[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine
CID 105326977
2-(2-bromophenyl)sulfanyl-1-quinolin-5-ylethanamine
CID 81229156
[(3-ethyl-2-pyridinyl)-quinolin-5-ylmethyl]hydrazine
CID 105263880
[2-(4-bromophenyl)-1-quinolin-5-ylethyl]hydrazine
CID 105195623
[(3-methoxypyrazin-2-yl)-quinolin-5-ylmethyl]hydrazine
CID 105332542
1-quinolin-5-ylethane-1,2-diamine
CID 55275195
(1R)-1-quinolin-5-ylethane-1,2-diamine
CID 66516625

Frequently Asked Questions

What is the IUPAC name of [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine?
The IUPAC name of [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine (CID 105208734) is [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine.
What is the SMILES notation for [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine?
The canonical SMILES for [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine is NNC(c1ccccc1Br)c1cccc2ncccc12.
What is the InChIKey of [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine?
The InChIKey is XIHOLWKCQXRODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrN3/c17-14-8-2-1-5-13(14)16(20-18)12-6-3-9-15-11(12)7-4-10-19-15/h1-10,16,20H,18H2.
What are the key properties of [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine?
[(2-bromophenyl)-quinolin-5-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 [(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine is sourced from PubChem (CID 105208734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).