[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine

C14H20BrFN2 — CID 105296167

IUPAC[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine
SMILESNNC(CC1CCCCC1)c1ccc(F)cc1Br
InChIInChI=1S/C14H20BrFN2/c15-13-9-11(16)6-7-12(13)14(18-17)8-10-4-2-1-3-5-10/h6-7,9-10,14,18H,1-5,8,17H2
InChIKeyGGTZINSSNQCAIG-UHFFFAOYSA-N
MW315.23 g/mol
LogP4.06
Rot. Bonds4

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

[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine (PubChem CID 105296167) has the molecular formula C14H20BrFN2 and a molecular weight of 315.23 g/mol. Its IUPAC name is [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine
PubChem CID105296167
Molecular FormulaC14H20BrFN2
Molecular Weight315.23 g/mol
Exact Mass314.08
IUPAC Name[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine
SMILESNNC(CC1CCCCC1)c1ccc(F)cc1Br
InChIInChI=1S/C14H20BrFN2/c15-13-9-11(16)6-7-12(13)14(18-17)8-10-4-2-1-3-5-10/h6-7,9-10,14,18H,1-5,8,17H2
InChIKeyGGTZINSSNQCAIG-UHFFFAOYSA-N
XLogP4.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.23
LogP ≤ 54.06
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-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine?
The IUPAC name of [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine (CID 105296167) is [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine is NNC(CC1CCCCC1)c1ccc(F)cc1Br.
What is the InChIKey of [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine?
The InChIKey is GGTZINSSNQCAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrFN2/c15-13-9-11(16)6-7-12(13)14(18-17)8-10-4-2-1-3-5-10/h6-7,9-10,14,18H,1-5,8,17H2.
What are the key properties of [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine?
[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine has a molecular weight of 315.23 g/mol, XLogP of 4.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine is sourced from PubChem (CID 105296167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).