[1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine

C8H13F3N2O — CID 165344018

IUPAC[1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine
SMILESC=C(C(NN)C1CCCO1)C(F)(F)F
InChIInChI=1S/C8H13F3N2O/c1-5(8(9,10)11)7(13-12)6-3-2-4-14-6/h6-7,13H,1-4,12H2
InChIKeyLDZAJVRMMMPNQY-UHFFFAOYSA-N
MW210.20 g/mol
LogP1.12
Rot. Bonds3

About [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine

[1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine (PubChem CID 165344018) has the molecular formula C8H13F3N2O and a molecular weight of 210.20 g/mol. Its IUPAC name is [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine.

Molecular Properties

Compound Name[1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine
PubChem CID165344018
Molecular FormulaC8H13F3N2O
Molecular Weight210.20 g/mol
Exact Mass210.10
IUPAC Name[1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine
SMILESC=C(C(NN)C1CCCO1)C(F)(F)F
InChIInChI=1S/C8H13F3N2O/c1-5(8(9,10)11)7(13-12)6-3-2-4-14-6/h6-7,13H,1-4,12H2
InChIKeyLDZAJVRMMMPNQY-UHFFFAOYSA-N
XLogP1.12
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.20
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine?
The IUPAC name of [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine (CID 165344018) is [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine.
What is the SMILES notation for [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine?
The canonical SMILES for [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine is C=C(C(NN)C1CCCO1)C(F)(F)F.
What is the InChIKey of [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine?
The InChIKey is LDZAJVRMMMPNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3N2O/c1-5(8(9,10)11)7(13-12)6-3-2-4-14-6/h6-7,13H,1-4,12H2.
What are the key properties of [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine?
[1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine has a molecular weight of 210.20 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxolan-2-yl)-2-(trifluoromethyl)prop-2-enyl]hydrazine is sourced from PubChem (CID 165344018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).