ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine

C15H34F3N — CID 143342931

IUPACethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine
SMILESC=N/C(=C\CC)C(F)(F)F.CC.CC.CC.CCC
InChIInChI=1S/C6H8F3N.C3H8.3C2H6/c1-3-4-5(10-2)6(7,8)9;1-3-2;3*1-2/h4H,2-3H2,1H3;3H2,1-2H3;3*1-2H3/b5-4-;;;;
InChIKeyLJCCFBNUWAMINZ-HCLDKOLZSA-N
MW285.44 g/mol
LogP7.04
Rot. Bonds2

About ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine

ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine (PubChem CID 143342931) has the molecular formula C15H34F3N and a molecular weight of 285.44 g/mol. Its IUPAC name is ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine.

Molecular Properties

Compound Nameethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine
PubChem CID143342931
Molecular FormulaC15H34F3N
Molecular Weight285.44 g/mol
Exact Mass285.26
IUPAC Nameethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine
SMILESC=N/C(=C\CC)C(F)(F)F.CC.CC.CC.CCC
InChIInChI=1S/C6H8F3N.C3H8.3C2H6/c1-3-4-5(10-2)6(7,8)9;1-3-2;3*1-2/h4H,2-3H2,1H3;3H2,1-2H3;3*1-2H3/b5-4-;;;;
InChIKeyLJCCFBNUWAMINZ-HCLDKOLZSA-N
XLogP7.04
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.44
LogP ≤ 57.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine with MolForge

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

Launch Full Analysis

Related Compounds

N-(1,1,1-trifluoropent-2-en-2-yl)methanimine
CID 91449965
N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine
CID 143342932
N-[(2Z,5Z)-1,1,1-trifluoro-4-methylnona-2,5-dien-2-yl]methanimine
CID 143588160
N-[(Z)-1,1,1-trifluoro-4-methylpent-2-en-2-yl]methanimine
CID 154964914

Frequently Asked Questions

What is the IUPAC name of ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine?
The IUPAC name of ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine (CID 143342931) is ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine.
What is the SMILES notation for ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine?
The canonical SMILES for ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine is C=N/C(=C\CC)C(F)(F)F.CC.CC.CC.CCC.
What is the InChIKey of ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine?
The InChIKey is LJCCFBNUWAMINZ-HCLDKOLZSA-N. The full InChI is InChI=1S/C6H8F3N.C3H8.3C2H6/c1-3-4-5(10-2)6(7,8)9;1-3-2;3*1-2/h4H,2-3H2,1H3;3H2,1-2H3;3*1-2H3/b5-4-;;;;.
What are the key properties of ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine?
ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine has a molecular weight of 285.44 g/mol, XLogP of 7.04, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;propane;N-[(Z)-1,1,1-trifluoropent-2-en-2-yl]methanimine is sourced from PubChem (CID 143342931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).