[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine

C16H13Cl2N3 — CID 105326912

IUPAC[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine
SMILESNNC(c1ccc(Cl)cc1Cl)c1cccc2ncccc12
InChIInChI=1S/C16H13Cl2N3/c17-10-6-7-13(14(18)9-10)16(21-19)12-3-1-5-15-11(12)4-2-8-20-15/h1-9,16,21H,19H2
InChIKeyZPDWBYXZGWTRBE-UHFFFAOYSA-N
MW318.21 g/mol
LogP4.09
Rot. Bonds3

About [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine

[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine (PubChem CID 105326912) has the molecular formula C16H13Cl2N3 and a molecular weight of 318.21 g/mol. Its IUPAC name is [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine
PubChem CID105326912
Molecular FormulaC16H13Cl2N3
Molecular Weight318.21 g/mol
Exact Mass317.05
IUPAC Name[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine
SMILESNNC(c1ccc(Cl)cc1Cl)c1cccc2ncccc12
InChIInChI=1S/C16H13Cl2N3/c17-10-6-7-13(14(18)9-10)16(21-19)12-3-1-5-15-11(12)4-2-8-20-15/h1-9,16,21H,19H2
InChIKeyZPDWBYXZGWTRBE-UHFFFAOYSA-N
XLogP4.09
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.21
LogP ≤ 54.09
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

1-(2,4-dichlorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 115604968
[phenyl(quinolin-5-yl)methyl]hydrazine
CID 105199350
[(2-iodophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326944
[(2-bromophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105208734
[(2-bromo-3-fluorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326935
1-(4-bromo-2-chlorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020044
1-(2-bromo-4-chlorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 107994637
[(4-bromo-3-fluorophenyl)-quinolin-5-ylmethyl]hydrazine
CID 105326969
(3-chloro-4-fluorophenyl)-quinolin-5-ylmethanamine
CID 81231315
(3,5-dichloro-2-pyridinyl)-quinolin-5-ylmethanol
CID 81220374
[(2-bromo-4-chlorophenyl)-quinolin-8-ylmethyl]hydrazine
CID 107997224
(2-chlorophenyl)-quinolin-5-ylmethanamine
CID 81231454

Frequently Asked Questions

What is the IUPAC name of [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine?
The IUPAC name of [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine (CID 105326912) is [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine.
What is the SMILES notation for [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine?
The canonical SMILES for [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine is NNC(c1ccc(Cl)cc1Cl)c1cccc2ncccc12.
What is the InChIKey of [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine?
The InChIKey is ZPDWBYXZGWTRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2N3/c17-10-6-7-13(14(18)9-10)16(21-19)12-3-1-5-15-11(12)4-2-8-20-15/h1-9,16,21H,19H2.
What are the key properties of [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine?
[(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine has a molecular weight of 318.21 g/mol, XLogP of 4.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dichlorophenyl)-quinolin-5-ylmethyl]hydrazine is sourced from PubChem (CID 105326912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).