1-methyl-2-(3,3,3-trifluoropropyl)hydrazine

C4H9F3N2 — CID 72508024

IUPAC1-methyl-2-(3,3,3-trifluoropropyl)hydrazine
SMILESCNNCCC(F)(F)F
InChIInChI=1S/C4H9F3N2/c1-8-9-3-2-4(5,6)7/h8-9H,2-3H2,1H3
InChIKeyXBSARHHPNBUZBP-UHFFFAOYSA-N
MW142.12 g/mol
LogP0.66
Rot. Bonds3

About 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine

1-methyl-2-(3,3,3-trifluoropropyl)hydrazine (PubChem CID 72508024) has the molecular formula C4H9F3N2 and a molecular weight of 142.12 g/mol. Its IUPAC name is 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine.

Molecular Properties

Compound Name1-methyl-2-(3,3,3-trifluoropropyl)hydrazine
PubChem CID72508024
Molecular FormulaC4H9F3N2
Molecular Weight142.12 g/mol
Exact Mass142.07
IUPAC Name1-methyl-2-(3,3,3-trifluoropropyl)hydrazine
SMILESCNNCCC(F)(F)F
InChIInChI=1S/C4H9F3N2/c1-8-9-3-2-4(5,6)7/h8-9H,2-3H2,1H3
InChIKeyXBSARHHPNBUZBP-UHFFFAOYSA-N
XLogP0.66
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.12
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine?
The IUPAC name of 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine (CID 72508024) is 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine.
What is the SMILES notation for 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine?
The canonical SMILES for 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine is CNNCCC(F)(F)F.
What is the InChIKey of 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine?
The InChIKey is XBSARHHPNBUZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9F3N2/c1-8-9-3-2-4(5,6)7/h8-9H,2-3H2,1H3.
What are the key properties of 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine?
1-methyl-2-(3,3,3-trifluoropropyl)hydrazine has a molecular weight of 142.12 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(3,3,3-trifluoropropyl)hydrazine is sourced from PubChem (CID 72508024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).