[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine

C15H14BrN3S — CID 105326977

IUPAC[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine
SMILESCc1cc(C(NN)c2cccc3ncccc23)sc1Br
InChIInChI=1S/C15H14BrN3S/c1-9-8-13(20-15(9)16)14(19-17)11-4-2-6-12-10(11)5-3-7-18-12/h2-8,14,19H,17H2,1H3
InChIKeySHPGLQIJNQMXEJ-UHFFFAOYSA-N
MW348.27 g/mol
LogP3.92
Rot. Bonds3

About [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine

[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine (PubChem CID 105326977) has the molecular formula C15H14BrN3S and a molecular weight of 348.27 g/mol. Its IUPAC name is [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine
PubChem CID105326977
Molecular FormulaC15H14BrN3S
Molecular Weight348.27 g/mol
Exact Mass347.01
IUPAC Name[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine
SMILESCc1cc(C(NN)c2cccc3ncccc23)sc1Br
InChIInChI=1S/C15H14BrN3S/c1-9-8-13(20-15(9)16)14(19-17)11-4-2-6-12-10(11)5-3-7-18-12/h2-8,14,19H,17H2,1H3
InChIKeySHPGLQIJNQMXEJ-UHFFFAOYSA-N
XLogP3.92
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.27
LogP ≤ 53.92
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

(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethanamine
CID 105020248
(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethanol
CID 115826296
1-(4,5-dimethylthiophen-2-yl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020135
[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105208734
N-[(4,5-dimethylthiophen-2-yl)-quinolin-5-ylmethyl]ethanamine
CID 105020108
[(2-bromo-3-fluorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326935
[phenyl(quinolin-5-yl)methyl]hydrazine
CID 105199350
[(5-bromo-4-methylthiophen-2-yl)-(2-propoxyphenyl)methyl]hydrazine
CID 105334423
[(5-bromo-4-methylthiophen-2-yl)-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
CID 107516730
(2-bromo-3-methylphenyl)-quinolin-5-ylmethanamine
CID 107985270
[(4-bromo-3-fluorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326969
[(2,5-dimethylpyrazol-3-yl)-quinolin-5-ylmethyl]hydrazine
CID 105326968

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine?
The IUPAC name of [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine (CID 105326977) is [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine.
What is the SMILES notation for [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine?
The canonical SMILES for [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine is Cc1cc(C(NN)c2cccc3ncccc23)sc1Br.
What is the InChIKey of [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine?
The InChIKey is SHPGLQIJNQMXEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3S/c1-9-8-13(20-15(9)16)14(19-17)11-4-2-6-12-10(11)5-3-7-18-12/h2-8,14,19H,17H2,1H3.
What are the key properties of [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine?
[(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine has a molecular weight of 348.27 g/mol, XLogP of 3.92, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-4-methylthiophen-2-yl)-quinolin-5-ylmethyl]hydrazine is sourced from PubChem (CID 105326977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).