[6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine

C10H21F3N2S — CID 105226769

IUPAC[6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine
SMILESCC(C)CSCC(CCCC(F)(F)F)NN
InChIInChI=1S/C10H21F3N2S/c1-8(2)6-16-7-9(15-14)4-3-5-10(11,12)13/h8-9,15H,3-7,14H2,1-2H3
InChIKeyWMMFRHKSTCESOZ-UHFFFAOYSA-N
MW258.35 g/mol
LogP2.94
Rot. Bonds8

About [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine

[6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine (PubChem CID 105226769) has the molecular formula C10H21F3N2S and a molecular weight of 258.35 g/mol. Its IUPAC name is [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine.

Molecular Properties

Compound Name[6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine
PubChem CID105226769
Molecular FormulaC10H21F3N2S
Molecular Weight258.35 g/mol
Exact Mass258.14
IUPAC Name[6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine
SMILESCC(C)CSCC(CCCC(F)(F)F)NN
InChIInChI=1S/C10H21F3N2S/c1-8(2)6-16-7-9(15-14)4-3-5-10(11,12)13/h8-9,15H,3-7,14H2,1-2H3
InChIKeyWMMFRHKSTCESOZ-UHFFFAOYSA-N
XLogP2.94
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 52.94
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

(8,8,8-trifluoro-2-methyloctan-4-yl)hydrazine
CID 105198922
8,8,8-trifluorooctan-4-ylhydrazine
CID 105202106
(5,5,5-trifluoro-1-methylsulfanylpentan-2-yl)hydrazine
CID 105213738
[1-(2-methylpropylsulfanyl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105226947
[7,7,7-trifluoro-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151566
1,1,1,6,6,6-hexafluorohexan-2-ylhydrazine
CID 105215662
[6,6,6-trifluoro-1-(4-methylphenyl)hexan-2-yl]hydrazine
CID 105211311
[1-(3-bromophenyl)sulfanyl-6,6,6-trifluorohexan-2-yl]hydrazine
CID 105238354
8,8,8-trifluoro-2-methyl-N-propyloctan-4-amine
CID 115516392
1,1,1,6,6,6-hexafluorohexan-3-ylhydrazine
CID 105205847
(1,1,1-trifluoro-7-methylsulfonylheptan-4-yl)hydrazine
CID 105248920
(1,1,1-trifluoro-6,6-dimethylheptan-4-yl)hydrazine
CID 105220163

Frequently Asked Questions

What is the IUPAC name of [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine?
The IUPAC name of [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine (CID 105226769) is [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine.
What is the SMILES notation for [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine?
The canonical SMILES for [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine is CC(C)CSCC(CCCC(F)(F)F)NN.
What is the InChIKey of [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine?
The InChIKey is WMMFRHKSTCESOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21F3N2S/c1-8(2)6-16-7-9(15-14)4-3-5-10(11,12)13/h8-9,15H,3-7,14H2,1-2H3.
What are the key properties of [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine?
[6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine has a molecular weight of 258.35 g/mol, XLogP of 2.94, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6,6,6-trifluoro-1-(2-methylpropylsulfanyl)hexan-2-yl]hydrazine is sourced from PubChem (CID 105226769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).