[3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine

C13H17FN2 — CID 105284054

IUPAC[3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1)C1CC2CC2C1
InChIInChI=1S/C13H17FN2/c14-12-3-1-8(2-4-12)13(16-15)11-6-9-5-10(9)7-11/h1-4,9-11,13,16H,5-7,15H2
InChIKeyJOJLNIYNQYHIHH-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.38
Rot. Bonds3

About [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine

[3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine (PubChem CID 105284054) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine
PubChem CID105284054
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC Name[3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1)C1CC2CC2C1
InChIInChI=1S/C13H17FN2/c14-12-3-1-8(2-4-12)13(16-15)11-6-9-5-10(9)7-11/h1-4,9-11,13,16H,5-7,15H2
InChIKeyJOJLNIYNQYHIHH-UHFFFAOYSA-N
XLogP2.38
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.38
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 [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine?
The IUPAC name of [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine (CID 105284054) is [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine is NNC(c1ccc(F)cc1)C1CC2CC2C1.
What is the InChIKey of [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine?
The InChIKey is JOJLNIYNQYHIHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c14-12-3-1-8(2-4-12)13(16-15)11-6-9-5-10(9)7-11/h1-4,9-11,13,16H,5-7,15H2.
What are the key properties of [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine?
[3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine has a molecular weight of 220.29 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-bicyclo[3.1.0]hexanyl-(4-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105284054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).