1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine

C9H12ClFN2 — CID 102623253

IUPAC1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine
SMILESCC(Cc1cc(F)ccc1Cl)NN
InChIInChI=1S/C9H12ClFN2/c1-6(13-12)4-7-5-8(11)2-3-9(7)10/h2-3,5-6,13H,4,12H2,1H3
InChIKeyJMDVKMXEQZCGRO-UHFFFAOYSA-N
MW202.66 g/mol
LogP1.87
Rot. Bonds3

About 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine

1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine (PubChem CID 102623253) has the molecular formula C9H12ClFN2 and a molecular weight of 202.66 g/mol. Its IUPAC name is 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine.

Molecular Properties

Compound Name1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine
PubChem CID102623253
Molecular FormulaC9H12ClFN2
Molecular Weight202.66 g/mol
Exact Mass202.07
IUPAC Name1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine
SMILESCC(Cc1cc(F)ccc1Cl)NN
InChIInChI=1S/C9H12ClFN2/c1-6(13-12)4-7-5-8(11)2-3-9(7)10/h2-3,5-6,13H,4,12H2,1H3
InChIKeyJMDVKMXEQZCGRO-UHFFFAOYSA-N
XLogP1.87
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.66
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine?
The IUPAC name of 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine (CID 102623253) is 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine.
What is the SMILES notation for 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine?
The canonical SMILES for 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine is CC(Cc1cc(F)ccc1Cl)NN.
What is the InChIKey of 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine?
The InChIKey is JMDVKMXEQZCGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClFN2/c1-6(13-12)4-7-5-8(11)2-3-9(7)10/h2-3,5-6,13H,4,12H2,1H3.
What are the key properties of 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine?
1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine has a molecular weight of 202.66 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine is sourced from PubChem (CID 102623253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).