(Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine

C7H8F6N2 — CID 134314199

IUPAC(Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine
SMILESC/N=C(/C=C(\NC)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H8F6N2/c1-14-4(6(8,9)10)3-5(15-2)7(11,12)13/h3,14H,1-2H3/b4-3-,15-5-
InChIKeyANCXZVLWCUVKPT-GVLLYKPYSA-N
MW234.14 g/mol
LogP2.29
Rot. Bonds2

About (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine

(Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine (PubChem CID 134314199) has the molecular formula C7H8F6N2 and a molecular weight of 234.14 g/mol. Its IUPAC name is (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine
PubChem CID134314199
Molecular FormulaC7H8F6N2
Molecular Weight234.14 g/mol
Exact Mass234.06
IUPAC Name(Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine
SMILESC/N=C(/C=C(\NC)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H8F6N2/c1-14-4(6(8,9)10)3-5(15-2)7(11,12)13/h3,14H,1-2H3/b4-3-,15-5-
InChIKeyANCXZVLWCUVKPT-GVLLYKPYSA-N
XLogP2.29
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.14
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine?
The IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine (CID 134314199) is (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine.
What is the SMILES notation for (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine?
The canonical SMILES for (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine is C/N=C(/C=C(\NC)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine?
The InChIKey is ANCXZVLWCUVKPT-GVLLYKPYSA-N. The full InChI is InChI=1S/C7H8F6N2/c1-14-4(6(8,9)10)3-5(15-2)7(11,12)13/h3,14H,1-2H3/b4-3-,15-5-.
What are the key properties of (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine?
(Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine has a molecular weight of 234.14 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,1,5,5,5-hexafluoro-N-methyl-4-methyliminopent-2-en-2-amine is sourced from PubChem (CID 134314199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).