[1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine

C13H13BrClN3 — CID 107997285

IUPAC[1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine
SMILESNNC(Cc1cccnc1)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H13BrClN3/c14-12-7-10(15)3-4-11(12)13(18-16)6-9-2-1-5-17-8-9/h1-5,7-8,13,18H,6,16H2
InChIKeyLGQSYLDAQZQULT-UHFFFAOYSA-N
MW326.63 g/mol
LogP3.24
Rot. Bonds4

About [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine

[1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine (PubChem CID 107997285) has the molecular formula C13H13BrClN3 and a molecular weight of 326.63 g/mol. Its IUPAC name is [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine
PubChem CID107997285
Molecular FormulaC13H13BrClN3
Molecular Weight326.63 g/mol
Exact Mass325.00
IUPAC Name[1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine
SMILESNNC(Cc1cccnc1)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H13BrClN3/c14-12-7-10(15)3-4-11(12)13(18-16)6-9-2-1-5-17-8-9/h1-5,7-8,13,18H,6,16H2
InChIKeyLGQSYLDAQZQULT-UHFFFAOYSA-N
XLogP3.24
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.63
LogP ≤ 53.24
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-bromo-4-methylphenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333676
[1-(2-bromo-4-chlorophenyl)-2-phenylethyl]hydrazine
CID 107996633
[1-(4-bromo-3-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine
CID 105333727
5-chloro-3-(1-hydrazinyl-2-pyridin-3-ylethyl)pyridin-2-amine
CID 105212191
[1-(2-bromo-4-chlorophenyl)-2-(4-iodophenyl)ethyl]hydrazine
CID 107997066
[1-(2-bromo-4-chlorophenyl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 107996645
4-bromo-2-(1-hydrazinyl-2-pyridin-3-ylethyl)aniline
CID 105263506
[1-(3-bromo-2-fluorophenyl)-2-pyridin-3-ylethyl]hydrazine
CID 106648787
[1-(4-chloro-2-fluorophenyl)-3-pyridin-3-ylpropyl]hydrazine
CID 105328422
[1-(2-bromo-5-chlorophenyl)-2-(3-chlorophenyl)ethyl]hydrazine
CID 114027293
[1-(2,4-dichlorophenyl)-3-pyridin-3-ylpropan-2-yl]hydrazine
CID 105200159
[1-(6-chloro-3-pyridinyl)-2-pyridin-3-ylethyl]hydrazine
CID 105253061

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine?
The IUPAC name of [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine (CID 107997285) is [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine is NNC(Cc1cccnc1)c1ccc(Cl)cc1Br.
What is the InChIKey of [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine?
The InChIKey is LGQSYLDAQZQULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrClN3/c14-12-7-10(15)3-4-11(12)13(18-16)6-9-2-1-5-17-8-9/h1-5,7-8,13,18H,6,16H2.
What are the key properties of [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine?
[1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine has a molecular weight of 326.63 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-chlorophenyl)-2-pyridin-3-ylethyl]hydrazine is sourced from PubChem (CID 107997285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).