(4,4-difluoro-1-methylcyclohexyl)methylhydrazine

C8H16F2N2 — CID 162571424

IUPAC(4,4-difluoro-1-methylcyclohexyl)methylhydrazine
SMILESCC1(CNN)CCC(F)(F)CC1
InChIInChI=1S/C8H16F2N2/c1-7(6-12-11)2-4-8(9,10)5-3-7/h12H,2-6,11H2,1H3
InChIKeyMNBTXQMNLFBOBQ-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.67
Rot. Bonds2

About (4,4-difluoro-1-methylcyclohexyl)methylhydrazine

(4,4-difluoro-1-methylcyclohexyl)methylhydrazine (PubChem CID 162571424) has the molecular formula C8H16F2N2 and a molecular weight of 178.23 g/mol. Its IUPAC name is (4,4-difluoro-1-methylcyclohexyl)methylhydrazine.

Molecular Properties

Compound Name(4,4-difluoro-1-methylcyclohexyl)methylhydrazine
PubChem CID162571424
Molecular FormulaC8H16F2N2
Molecular Weight178.23 g/mol
Exact Mass178.13
IUPAC Name(4,4-difluoro-1-methylcyclohexyl)methylhydrazine
SMILESCC1(CNN)CCC(F)(F)CC1
InChIInChI=1S/C8H16F2N2/c1-7(6-12-11)2-4-8(9,10)5-3-7/h12H,2-6,11H2,1H3
InChIKeyMNBTXQMNLFBOBQ-UHFFFAOYSA-N
XLogP1.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.67
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 (4,4-difluoro-1-methylcyclohexyl)methylhydrazine?
The IUPAC name of (4,4-difluoro-1-methylcyclohexyl)methylhydrazine (CID 162571424) is (4,4-difluoro-1-methylcyclohexyl)methylhydrazine.
What is the SMILES notation for (4,4-difluoro-1-methylcyclohexyl)methylhydrazine?
The canonical SMILES for (4,4-difluoro-1-methylcyclohexyl)methylhydrazine is CC1(CNN)CCC(F)(F)CC1.
What is the InChIKey of (4,4-difluoro-1-methylcyclohexyl)methylhydrazine?
The InChIKey is MNBTXQMNLFBOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2N2/c1-7(6-12-11)2-4-8(9,10)5-3-7/h12H,2-6,11H2,1H3.
What are the key properties of (4,4-difluoro-1-methylcyclohexyl)methylhydrazine?
(4,4-difluoro-1-methylcyclohexyl)methylhydrazine has a molecular weight of 178.23 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-difluoro-1-methylcyclohexyl)methylhydrazine is sourced from PubChem (CID 162571424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).