2-(trifluoromethyl)prop-2-enylhydrazine

C4H7F3N2 — CID 130565178

IUPAC2-(trifluoromethyl)prop-2-enylhydrazine
SMILESC=C(CNN)C(F)(F)F
InChIInChI=1S/C4H7F3N2/c1-3(2-9-8)4(5,6)7/h9H,1-2,8H2
InChIKeyNDQWVUZJUSNPID-UHFFFAOYSA-N
MW140.11 g/mol
LogP0.57
Rot. Bonds2

About 2-(trifluoromethyl)prop-2-enylhydrazine

2-(trifluoromethyl)prop-2-enylhydrazine (PubChem CID 130565178) has the molecular formula C4H7F3N2 and a molecular weight of 140.11 g/mol. Its IUPAC name is 2-(trifluoromethyl)prop-2-enylhydrazine.

Molecular Properties

Compound Name2-(trifluoromethyl)prop-2-enylhydrazine
PubChem CID130565178
Molecular FormulaC4H7F3N2
Molecular Weight140.11 g/mol
Exact Mass140.06
IUPAC Name2-(trifluoromethyl)prop-2-enylhydrazine
SMILESC=C(CNN)C(F)(F)F
InChIInChI=1S/C4H7F3N2/c1-3(2-9-8)4(5,6)7/h9H,1-2,8H2
InChIKeyNDQWVUZJUSNPID-UHFFFAOYSA-N
XLogP0.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.11
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 2-(trifluoromethyl)prop-2-enylhydrazine?
The IUPAC name of 2-(trifluoromethyl)prop-2-enylhydrazine (CID 130565178) is 2-(trifluoromethyl)prop-2-enylhydrazine.
What is the SMILES notation for 2-(trifluoromethyl)prop-2-enylhydrazine?
The canonical SMILES for 2-(trifluoromethyl)prop-2-enylhydrazine is C=C(CNN)C(F)(F)F.
What is the InChIKey of 2-(trifluoromethyl)prop-2-enylhydrazine?
The InChIKey is NDQWVUZJUSNPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F3N2/c1-3(2-9-8)4(5,6)7/h9H,1-2,8H2.
What are the key properties of 2-(trifluoromethyl)prop-2-enylhydrazine?
2-(trifluoromethyl)prop-2-enylhydrazine has a molecular weight of 140.11 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)prop-2-enylhydrazine is sourced from PubChem (CID 130565178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).