[6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine

C10H21F3N2O2 — CID 103151628

IUPAC[6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
SMILESCOCCC(C)C(CCOCC(F)(F)F)NN
InChIInChI=1S/C10H21F3N2O2/c1-8(3-5-16-2)9(15-14)4-6-17-7-10(11,12)13/h8-9,15H,3-7,14H2,1-2H3
InChIKeyYWPTZVKGFBBFBS-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.46
Rot. Bonds9

About [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine

[6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine (PubChem CID 103151628) has the molecular formula C10H21F3N2O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine.

Molecular Properties

Compound Name[6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
PubChem CID103151628
Molecular FormulaC10H21F3N2O2
Molecular Weight258.28 g/mol
Exact Mass258.16
IUPAC Name[6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
SMILESCOCCC(C)C(CCOCC(F)(F)F)NN
InChIInChI=1S/C10H21F3N2O2/c1-8(3-5-16-2)9(15-14)4-6-17-7-10(11,12)13/h8-9,15H,3-7,14H2,1-2H3
InChIKeyYWPTZVKGFBBFBS-UHFFFAOYSA-N
XLogP1.46
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[6,6,6-Trifluoro-1-(2-methoxyethoxy)hexan-3-yl]hydrazine
CID 102929807
6-Methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 103148154
1-(2,2-Difluoroethoxy)-6-methoxy-4-methylhexan-3-amine
CID 103149054
[7-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151446
[5-Methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151447
[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
[1-Cyclopropyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151495
[1-Cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151497
[5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-yl]hydrazine
CID 103151536
[1-(Oxolan-3-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151559
[5-Ethyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151573

Frequently Asked Questions

What is the IUPAC name of [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine?
The IUPAC name of [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine (CID 103151628) is [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine.
What is the SMILES notation for [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine?
The canonical SMILES for [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine is COCCC(C)C(CCOCC(F)(F)F)NN.
What is the InChIKey of [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine?
The InChIKey is YWPTZVKGFBBFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21F3N2O2/c1-8(3-5-16-2)9(15-14)4-6-17-7-10(11,12)13/h8-9,15H,3-7,14H2,1-2H3.
What are the key properties of [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine?
[6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine has a molecular weight of 258.28 g/mol, XLogP of 1.46, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methoxy-4-methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine is sourced from PubChem (CID 103151628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).