[1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine

C16H24F2N2 — CID 114216850

IUPAC[1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1ccc(C)c(CC(NN)C2CCCC(F)(F)C2)c1
InChIInChI=1S/C16H24F2N2/c1-11-5-6-12(2)14(8-11)9-15(20-19)13-4-3-7-16(17,18)10-13/h5-6,8,13,15,20H,3-4,7,9-10,19H2,1-2H3
InChIKeyFROJRPSKKQQQFY-UHFFFAOYSA-N
MW282.38 g/mol
LogP3.50
Rot. Bonds4

About [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine

[1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine (PubChem CID 114216850) has the molecular formula C16H24F2N2 and a molecular weight of 282.38 g/mol. Its IUPAC name is [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
PubChem CID114216850
Molecular FormulaC16H24F2N2
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name[1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1ccc(C)c(CC(NN)C2CCCC(F)(F)C2)c1
InChIInChI=1S/C16H24F2N2/c1-11-5-6-12(2)14(8-11)9-15(20-19)13-4-3-7-16(17,18)10-13/h5-6,8,13,15,20H,3-4,7,9-10,19H2,1-2H3
InChIKeyFROJRPSKKQQQFY-UHFFFAOYSA-N
XLogP3.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 53.50
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-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine (CID 114216850) is [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine is Cc1ccc(C)c(CC(NN)C2CCCC(F)(F)C2)c1.
What is the InChIKey of [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
The InChIKey is FROJRPSKKQQQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24F2N2/c1-11-5-6-12(2)14(8-11)9-15(20-19)13-4-3-7-16(17,18)10-13/h5-6,8,13,15,20H,3-4,7,9-10,19H2,1-2H3.
What are the key properties of [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine?
[1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine has a molecular weight of 282.38 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,3-difluorocyclohexyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 114216850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).