1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine

C5H9F3N2 — CID 123812169

IUPAC1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine
SMILESCC(=CC(F)(F)F)N(C)N
InChIInChI=1S/C5H9F3N2/c1-4(10(2)9)3-5(6,7)8/h3H,9H2,1-2H3
InChIKeyFGRMGRGZHWHNOW-UHFFFAOYSA-N
MW154.13 g/mol
LogP1.26
Rot. Bonds1

About 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine

1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine (PubChem CID 123812169) has the molecular formula C5H9F3N2 and a molecular weight of 154.13 g/mol. Its IUPAC name is 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine.

Molecular Properties

Compound Name1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine
PubChem CID123812169
Molecular FormulaC5H9F3N2
Molecular Weight154.13 g/mol
Exact Mass154.07
IUPAC Name1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine
SMILESCC(=CC(F)(F)F)N(C)N
InChIInChI=1S/C5H9F3N2/c1-4(10(2)9)3-5(6,7)8/h3H,9H2,1-2H3
InChIKeyFGRMGRGZHWHNOW-UHFFFAOYSA-N
XLogP1.26
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.13
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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1-[(Z)-but-2-en-2-yl]-1-(2-fluoroethyl)hydrazine
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1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine
CID 168933134
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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine?
The IUPAC name of 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine (CID 123812169) is 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine.
What is the SMILES notation for 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine?
The canonical SMILES for 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine is CC(=CC(F)(F)F)N(C)N.
What is the InChIKey of 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine?
The InChIKey is FGRMGRGZHWHNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F3N2/c1-4(10(2)9)3-5(6,7)8/h3H,9H2,1-2H3.
What are the key properties of 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine?
1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine has a molecular weight of 154.13 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-(4,4,4-trifluorobut-2-en-2-yl)hydrazine is sourced from PubChem (CID 123812169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).