[3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine

C8H17F3N2O — CID 103217673

IUPAC[3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine
SMILESCCC(C)C(COCC(F)(F)F)NN
InChIInChI=1S/C8H17F3N2O/c1-3-6(2)7(13-12)4-14-5-8(9,10)11/h6-7,13H,3-5,12H2,1-2H3
InChIKeyKPIBJQWUVSONBW-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.44
Rot. Bonds6

About [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine

[3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine (PubChem CID 103217673) has the molecular formula C8H17F3N2O and a molecular weight of 214.23 g/mol. Its IUPAC name is [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine
PubChem CID103217673
Molecular FormulaC8H17F3N2O
Molecular Weight214.23 g/mol
Exact Mass214.13
IUPAC Name[3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine
SMILESCCC(C)C(COCC(F)(F)F)NN
InChIInChI=1S/C8H17F3N2O/c1-3-6(2)7(13-12)4-14-5-8(9,10)11/h6-7,13H,3-5,12H2,1-2H3
InChIKeyKPIBJQWUVSONBW-UHFFFAOYSA-N
XLogP1.44
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3-Methyl-1-(2,2,2-trifluoroethoxy)pentan-2-amine
CID 80445875
1-(2,2-Difluoroethoxy)-3-methylpentan-2-amine
CID 82004242
3-Methyl-1-(4,4,4-trifluorobutoxy)pentan-2-amine
CID 82788380
3-Methyl-1-(3,3,3-trifluoropropoxy)pentan-2-amine
CID 82955026
[4-Methyl-1-(2,2,2-trifluoroethoxy)pentan-3-yl]hydrazine
CID 103151458
[5-Methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
CID 103151460
[4-Ethyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
CID 103151592
[6-Methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
CID 103151628
[4-Methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
CID 103151654
[1-(2,2-Difluoroethoxy)-4-methylpentan-3-yl]hydrazine
CID 103151777
[1-(2,2-Difluoroethoxy)-5-methylhexan-3-yl]hydrazine
CID 103151779
[1-(2,2-Difluoroethoxy)-4-ethylhexan-3-yl]hydrazine
CID 103151915

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine?
The IUPAC name of [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine (CID 103217673) is [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine.
What is the SMILES notation for [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine?
The canonical SMILES for [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine is CCC(C)C(COCC(F)(F)F)NN.
What is the InChIKey of [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine?
The InChIKey is KPIBJQWUVSONBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17F3N2O/c1-3-6(2)7(13-12)4-14-5-8(9,10)11/h6-7,13H,3-5,12H2,1-2H3.
What are the key properties of [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine?
[3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine has a molecular weight of 214.23 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine is sourced from PubChem (CID 103217673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).