(Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine

C6H8F3N — CID 142439237

IUPAC(Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine
SMILESC/C=C\C(=N/C)C(F)(F)F
InChIInChI=1S/C6H8F3N/c1-3-4-5(10-2)6(7,8)9/h3-4H,1-2H3/b4-3-,10-5+
InChIKeyGSBKSWKXRVEENU-DXWLQBKVSA-N
MW151.13 g/mol
LogP2.20
Rot. Bonds1

About (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine

(Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine (PubChem CID 142439237) has the molecular formula C6H8F3N and a molecular weight of 151.13 g/mol. Its IUPAC name is (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine.

Molecular Properties

Compound Name(Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine
PubChem CID142439237
Molecular FormulaC6H8F3N
Molecular Weight151.13 g/mol
Exact Mass151.06
IUPAC Name(Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine
SMILESC/C=C\C(=N/C)C(F)(F)F
InChIInChI=1S/C6H8F3N/c1-3-4-5(10-2)6(7,8)9/h3-4H,1-2H3/b4-3-,10-5+
InChIKeyGSBKSWKXRVEENU-DXWLQBKVSA-N
XLogP2.20
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.13
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine 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-trifluoro-N-methylpent-3-en-2-imine?
The IUPAC name of (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine (CID 142439237) is (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine.
What is the SMILES notation for (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine?
The canonical SMILES for (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine is C/C=C\C(=N/C)C(F)(F)F.
What is the InChIKey of (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine?
The InChIKey is GSBKSWKXRVEENU-DXWLQBKVSA-N. The full InChI is InChI=1S/C6H8F3N/c1-3-4-5(10-2)6(7,8)9/h3-4H,1-2H3/b4-3-,10-5+.
What are the key properties of (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine?
(Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine has a molecular weight of 151.13 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,1-trifluoro-N-methylpent-3-en-2-imine is sourced from PubChem (CID 142439237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).