[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine

C12H12BrFN4 — CID 105203629

IUPAC[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
SMILESNNC(Cc1ccc(F)cc1Br)c1ncccn1
InChIInChI=1S/C12H12BrFN4/c13-10-7-9(14)3-2-8(10)6-11(18-15)12-16-4-1-5-17-12/h1-5,7,11,18H,6,15H2
InChIKeyZNESUILCXLNBMH-UHFFFAOYSA-N
MW311.16 g/mol
LogP2.13
Rot. Bonds4

About [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine

[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine (PubChem CID 105203629) has the molecular formula C12H12BrFN4 and a molecular weight of 311.16 g/mol. Its IUPAC name is [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
PubChem CID105203629
Molecular FormulaC12H12BrFN4
Molecular Weight311.16 g/mol
Exact Mass310.02
IUPAC Name[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
SMILESNNC(Cc1ccc(F)cc1Br)c1ncccn1
InChIInChI=1S/C12H12BrFN4/c13-10-7-9(14)3-2-8(10)6-11(18-15)12-16-4-1-5-17-12/h1-5,7,11,18H,6,15H2
InChIKeyZNESUILCXLNBMH-UHFFFAOYSA-N
XLogP2.13
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.16
LogP ≤ 52.13
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'}

Analyze [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(2-bromo-5-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203759
[2-(2-bromo-4-fluorophenyl)-1-(3-fluoro-2-pyridinyl)ethyl]hydrazine
CID 105257780
[2-(2-bromo-4-fluorophenyl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105258571
[1-(3-bromo-2-pyridinyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105268167
[2-(2-bromo-4-fluorophenyl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261810
[2-(2-bromo-4-fluorophenyl)-1-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105194059
[1-(3-bromo-2-chlorophenyl)-2-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105296712
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261623
[2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105296596
[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105296699
[1-(3-bromo-4-chlorophenyl)-2-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105260939
4-[2-(2-bromo-4-fluorophenyl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
CID 105231120

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine?
The IUPAC name of [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine (CID 105203629) is [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine is NNC(Cc1ccc(F)cc1Br)c1ncccn1.
What is the InChIKey of [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine?
The InChIKey is ZNESUILCXLNBMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrFN4/c13-10-7-9(14)3-2-8(10)6-11(18-15)12-16-4-1-5-17-12/h1-5,7,11,18H,6,15H2.
What are the key properties of [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine?
[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine has a molecular weight of 311.16 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine is sourced from PubChem (CID 105203629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).