[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

C10H17F3N2O — CID 106649723

IUPAC[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESNNC(COCC(F)(F)F)C1=CCCCC1
InChIInChI=1S/C10H17F3N2O/c11-10(12,13)7-16-6-9(15-14)8-4-2-1-3-5-8/h4,9,15H,1-3,5-7,14H2
InChIKeyKJKZZSQXZMUPER-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.90
Rot. Bonds5

About [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (PubChem CID 106649723) has the molecular formula C10H17F3N2O and a molecular weight of 238.25 g/mol. Its IUPAC name is [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
PubChem CID106649723
Molecular FormulaC10H17F3N2O
Molecular Weight238.25 g/mol
Exact Mass238.13
IUPAC Name[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESNNC(COCC(F)(F)F)C1=CCCCC1
InChIInChI=1S/C10H17F3N2O/c11-10(12,13)7-16-6-9(15-14)8-4-2-1-3-5-8/h4,9,15H,1-3,5-7,14H2
InChIKeyKJKZZSQXZMUPER-UHFFFAOYSA-N
XLogP1.90
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.90
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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Related Compounds

3-[3-(2,2,2-Trifluoroethoxy)propyl]cyclohex-2-en-1-amine
CID 65172107
[(4,4-difluorocyclohexyl)-(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102650320
[(4,4-Difluorocyclohexyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654507
1-(Cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103207498
1-(Cyclohepten-1-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103207518
[1-(Cyclohexen-1-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 106649701
[1-(Cycloocten-1-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 106649702
[1-(Cyclohepten-1-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 106649703
[1-(Cyclohexen-1-yl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 106649705
[1-(Cycloocten-1-yl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 106649706
[1-(Cyclohepten-1-yl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 106649707
[1-(Cycloocten-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 106649724

Frequently Asked Questions

What is the IUPAC name of [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The IUPAC name of [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (CID 106649723) is [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.
What is the SMILES notation for [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The canonical SMILES for [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is NNC(COCC(F)(F)F)C1=CCCCC1.
What is the InChIKey of [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The InChIKey is KJKZZSQXZMUPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O/c11-10(12,13)7-16-6-9(15-14)8-4-2-1-3-5-8/h4,9,15H,1-3,5-7,14H2.
What are the key properties of [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine has a molecular weight of 238.25 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is sourced from PubChem (CID 106649723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).