[2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine

C13H12BrClFN3 — CID 105258636

IUPAC[2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cc1Cl)c1ccncc1F
InChIInChI=1S/C13H12BrClFN3/c14-9-2-1-8(11(15)6-9)5-13(19-17)10-3-4-18-7-12(10)16/h1-4,6-7,13,19H,5,17H2
InChIKeyIZQYGAMWULSECF-UHFFFAOYSA-N
MW344.62 g/mol
LogP3.38
Rot. Bonds4

About [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine

[2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine (PubChem CID 105258636) has the molecular formula C13H12BrClFN3 and a molecular weight of 344.62 g/mol. Its IUPAC name is [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
PubChem CID105258636
Molecular FormulaC13H12BrClFN3
Molecular Weight344.62 g/mol
Exact Mass342.99
IUPAC Name[2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Br)cc1Cl)c1ccncc1F
InChIInChI=1S/C13H12BrClFN3/c14-9-2-1-8(11(15)6-9)5-13(19-17)10-3-4-18-7-12(10)16/h1-4,6-7,13,19H,5,17H2
InChIKeyIZQYGAMWULSECF-UHFFFAOYSA-N
XLogP3.38
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.62
LogP ≤ 53.38
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-(2-bromo-4-fluorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105258571
[2-(4-bromo-2-chlorophenyl)-1-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105335194
[2-(4-bromo-2-chlorophenyl)-1-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 105223390
[2-(4-bromo-2-chlorophenyl)-1-(5-chloro-2-iodophenyl)ethyl]hydrazine
CID 114030639
[2-(2,4-dichlorophenyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105200174
[2-(4-bromo-2-chlorophenyl)-1-(2-chloro-4-pyridinyl)ethyl]hydrazine
CID 105252774
N-[2-(2-chloro-4-methylphenyl)-1-(3-fluoro-4-pyridinyl)ethyl]propan-1-amine
CID 106866904
[1-(3-bromo-2-chlorophenyl)-2-(4-bromo-2-chlorophenyl)ethyl]hydrazine
CID 105335248
[1-(4-bromo-2-fluorophenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105281009
[2-(4-bromo-2-chlorophenyl)-1-(2-bromo-4-methylphenyl)ethyl]hydrazine
CID 105335180
[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
CID 105206013
[1-(5-bromo-2-methylphenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868638

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine (CID 105258636) is [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine is NNC(Cc1ccc(Br)cc1Cl)c1ccncc1F.
What is the InChIKey of [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
The InChIKey is IZQYGAMWULSECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12BrClFN3/c14-9-2-1-8(11(15)6-9)5-13(19-17)10-3-4-18-7-12(10)16/h1-4,6-7,13,19H,5,17H2.
What are the key properties of [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine?
[2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine has a molecular weight of 344.62 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromo-2-chlorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105258636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).