1,1,1-trifluoropropan-2-ylhydrazine

C3H7F3N2 — CID 20541215

IUPAC1,1,1-trifluoropropan-2-ylhydrazine
SMILESCC(NN)C(F)(F)F
InChIInChI=1S/C3H7F3N2/c1-2(8-7)3(4,5)6/h2,8H,7H2,1H3
InChIKeyYPZSTBLQZNOTDH-UHFFFAOYSA-N
MW128.10 g/mol
LogP0.40
Rot. Bonds1

About 1,1,1-trifluoropropan-2-ylhydrazine

1,1,1-trifluoropropan-2-ylhydrazine (PubChem CID 20541215) has the molecular formula C3H7F3N2 and a molecular weight of 128.10 g/mol. Its IUPAC name is 1,1,1-trifluoropropan-2-ylhydrazine.

Molecular Properties

Compound Name1,1,1-trifluoropropan-2-ylhydrazine
PubChem CID20541215
Molecular FormulaC3H7F3N2
Molecular Weight128.10 g/mol
Exact Mass128.06
IUPAC Name1,1,1-trifluoropropan-2-ylhydrazine
SMILESCC(NN)C(F)(F)F
InChIInChI=1S/C3H7F3N2/c1-2(8-7)3(4,5)6/h2,8H,7H2,1H3
InChIKeyYPZSTBLQZNOTDH-UHFFFAOYSA-N
XLogP0.40
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.10
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1,1,1-trifluoropropan-2-ylhydrazine 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 1,1,1-trifluoropropan-2-ylhydrazine?
The IUPAC name of 1,1,1-trifluoropropan-2-ylhydrazine (CID 20541215) is 1,1,1-trifluoropropan-2-ylhydrazine.
What is the SMILES notation for 1,1,1-trifluoropropan-2-ylhydrazine?
The canonical SMILES for 1,1,1-trifluoropropan-2-ylhydrazine is CC(NN)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoropropan-2-ylhydrazine?
The InChIKey is YPZSTBLQZNOTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F3N2/c1-2(8-7)3(4,5)6/h2,8H,7H2,1H3.
What are the key properties of 1,1,1-trifluoropropan-2-ylhydrazine?
1,1,1-trifluoropropan-2-ylhydrazine has a molecular weight of 128.10 g/mol, XLogP of 0.40, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoropropan-2-ylhydrazine is sourced from PubChem (CID 20541215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).