[2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine

C16H24ClFN2 — CID 107895103

IUPAC[2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
SMILESCC1(C)CCC(C(Cc2ccc(Cl)c(F)c2)NN)CC1
InChIInChI=1S/C16H24ClFN2/c1-16(2)7-5-12(6-8-16)15(20-19)10-11-3-4-13(17)14(18)9-11/h3-4,9,12,15,20H,5-8,10,19H2,1-2H3
InChIKeyQBXZINLGXBOTAS-UHFFFAOYSA-N
MW298.83 g/mol
LogP4.07
Rot. Bonds4

About [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine

[2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine (PubChem CID 107895103) has the molecular formula C16H24ClFN2 and a molecular weight of 298.83 g/mol. Its IUPAC name is [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
PubChem CID107895103
Molecular FormulaC16H24ClFN2
Molecular Weight298.83 g/mol
Exact Mass298.16
IUPAC Name[2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
SMILESCC1(C)CCC(C(Cc2ccc(Cl)c(F)c2)NN)CC1
InChIInChI=1S/C16H24ClFN2/c1-16(2)7-5-12(6-8-16)15(20-19)10-11-3-4-13(17)14(18)9-11/h3-4,9,12,15,20H,5-8,10,19H2,1-2H3
InChIKeyQBXZINLGXBOTAS-UHFFFAOYSA-N
XLogP4.07
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.83
LogP ≤ 54.07
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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Related Compounds

[2-(4-chloro-3-fluorophenyl)-1-(4-methylcyclohexyl)ethyl]hydrazine
CID 114013679
[2-(4-chlorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105231866
[2-(4-bromo-2-chlorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105231757
[2-(3-bromo-5-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105231693
[1-cyclohexyl-2-(3,4-difluorophenyl)ethyl]hydrazine
CID 105201895
2-(4-chloro-3-fluorophenyl)-1-(2,2-dimethylcyclohexyl)-N-methylethanamine
CID 107892144
[1-(4-chloro-3-fluorophenyl)-3-cyclobutylpropan-2-yl]hydrazine
CID 107895453
[2-(4-chloro-3-fluorophenyl)-1-(1,4-dithian-2-yl)ethyl]hydrazine
CID 107895212
[2-(3-chloro-4-fluorophenyl)-1-(2,2-dimethylcyclohexyl)ethyl]hydrazine
CID 107195040
[2-(3-chloro-4-pyridinyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105231726
2-(3-bromo-4-fluorophenyl)-1-(4,4-dimethylcyclohexyl)-N-methylethanamine
CID 65390837
1-[2-(4-chloro-3-fluorophenyl)-1-hydrazinylethyl]-N,N-dimethylcyclopentan-1-amine
CID 107895172

Frequently Asked Questions

What is the IUPAC name of [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine?
The IUPAC name of [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine (CID 107895103) is [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine is CC1(C)CCC(C(Cc2ccc(Cl)c(F)c2)NN)CC1.
What is the InChIKey of [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine?
The InChIKey is QBXZINLGXBOTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClFN2/c1-16(2)7-5-12(6-8-16)15(20-19)10-11-3-4-13(17)14(18)9-11/h3-4,9,12,15,20H,5-8,10,19H2,1-2H3.
What are the key properties of [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine?
[2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine has a molecular weight of 298.83 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chloro-3-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine is sourced from PubChem (CID 107895103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).