2,2-difluoro-6-iminocyclohexan-1-amine

C6H10F2N2 — CID 162618620

IUPAC2,2-difluoro-6-iminocyclohexan-1-amine
SMILES[H]/N=C1\CCCC(F)(F)C1N
InChIInChI=1S/C6H10F2N2/c7-6(8)3-1-2-4(9)5(6)10/h5,9H,1-3,10H2/b9-4+
InChIKeyPXGUONYJTORFLG-RUDMXATFSA-N
MW148.16 g/mol
LogP1.15
Rot. Bonds

About 2,2-difluoro-6-iminocyclohexan-1-amine

2,2-difluoro-6-iminocyclohexan-1-amine (PubChem CID 162618620) has the molecular formula C6H10F2N2 and a molecular weight of 148.16 g/mol. Its IUPAC name is 2,2-difluoro-6-iminocyclohexan-1-amine.

Molecular Properties

Compound Name2,2-difluoro-6-iminocyclohexan-1-amine
PubChem CID162618620
Molecular FormulaC6H10F2N2
Molecular Weight148.16 g/mol
Exact Mass148.08
IUPAC Name2,2-difluoro-6-iminocyclohexan-1-amine
SMILES[H]/N=C1\CCCC(F)(F)C1N
InChIInChI=1S/C6H10F2N2/c7-6(8)3-1-2-4(9)5(6)10/h5,9H,1-3,10H2/b9-4+
InChIKeyPXGUONYJTORFLG-RUDMXATFSA-N
XLogP1.15
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-6-iminocyclohexan-1-amine?
The IUPAC name of 2,2-difluoro-6-iminocyclohexan-1-amine (CID 162618620) is 2,2-difluoro-6-iminocyclohexan-1-amine.
What is the SMILES notation for 2,2-difluoro-6-iminocyclohexan-1-amine?
The canonical SMILES for 2,2-difluoro-6-iminocyclohexan-1-amine is [H]/N=C1\CCCC(F)(F)C1N.
What is the InChIKey of 2,2-difluoro-6-iminocyclohexan-1-amine?
The InChIKey is PXGUONYJTORFLG-RUDMXATFSA-N. The full InChI is InChI=1S/C6H10F2N2/c7-6(8)3-1-2-4(9)5(6)10/h5,9H,1-3,10H2/b9-4+.
What are the key properties of 2,2-difluoro-6-iminocyclohexan-1-amine?
2,2-difluoro-6-iminocyclohexan-1-amine has a molecular weight of 148.16 g/mol, XLogP of 1.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-6-iminocyclohexan-1-amine is sourced from PubChem (CID 162618620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).