[(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine

C16H13Br2N3 — CID 107979324

IUPAC[(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine
SMILESNNC(c1cc(Br)cc(Br)c1)c1cccc2cccnc12
InChIInChI=1S/C16H13Br2N3/c17-12-7-11(8-13(18)9-12)16(21-19)14-5-1-3-10-4-2-6-20-15(10)14/h1-9,16,21H,19H2
InChIKeyFHDJWTRHLVWQFM-UHFFFAOYSA-N
MW407.11 g/mol
LogP4.31
Rot. Bonds3

About [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine

[(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine (PubChem CID 107979324) has the molecular formula C16H13Br2N3 and a molecular weight of 407.11 g/mol. Its IUPAC name is [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine
PubChem CID107979324
Molecular FormulaC16H13Br2N3
Molecular Weight407.11 g/mol
Exact Mass404.95
IUPAC Name[(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine
SMILESNNC(c1cc(Br)cc(Br)c1)c1cccc2cccnc12
InChIInChI=1S/C16H13Br2N3/c17-12-7-11(8-13(18)9-12)16(21-19)14-5-1-3-10-4-2-6-20-15(10)14/h1-9,16,21H,19H2
InChIKeyFHDJWTRHLVWQFM-UHFFFAOYSA-N
XLogP4.31
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.11
LogP ≤ 54.31
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

[(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105200639
[(4-fluorophenyl)-quinolin-8-ylmethyl]hydrazine
CID 105192623
[(3,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105300235
[(4-methoxyphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105190768
[(3,5-dibromophenyl)-isoquinolin-5-ylmethyl]hydrazine
CID 107979075
[(2-bromo-4-chlorophenyl)-quinolin-8-ylmethyl]hydrazine
CID 107997224
[(4-ethylphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105197296
1-(4-bromophenyl)-N-methyl-1-quinolin-8-ylmethanamine
CID 78917786
[(2,4-dimethylphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105304674
[quinolin-8-yl(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230361
[quinolin-8-yl(1,3-thiazol-5-yl)methyl]hydrazine
CID 105253658
[(2,6-dimethyl-3-pyridinyl)-quinolin-8-ylmethyl]hydrazine
CID 105327389

Frequently Asked Questions

What is the IUPAC name of [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine?
The IUPAC name of [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine (CID 107979324) is [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine.
What is the SMILES notation for [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine?
The canonical SMILES for [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine is NNC(c1cc(Br)cc(Br)c1)c1cccc2cccnc12.
What is the InChIKey of [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine?
The InChIKey is FHDJWTRHLVWQFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Br2N3/c17-12-7-11(8-13(18)9-12)16(21-19)14-5-1-3-10-4-2-6-20-15(10)14/h1-9,16,21H,19H2.
What are the key properties of [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine?
[(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine has a molecular weight of 407.11 g/mol, XLogP of 4.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dibromophenyl)-quinolin-8-ylmethyl]hydrazine is sourced from PubChem (CID 107979324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).