[3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine

C13H28N2O — CID 105306512

IUPAC[3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine
SMILESCC(CC(NN)C1CCOC1)CC(C)(C)C
InChIInChI=1S/C13H28N2O/c1-10(8-13(2,3)4)7-12(15-14)11-5-6-16-9-11/h10-12,15H,5-9,14H2,1-4H3
InChIKeyFFKDWNXUJICROR-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.32
Rot. Bonds5

About [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine

[3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine (PubChem CID 105306512) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine.

Molecular Properties

Compound Name[3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine
PubChem CID105306512
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name[3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine
SMILESCC(CC(NN)C1CCOC1)CC(C)(C)C
InChIInChI=1S/C13H28N2O/c1-10(8-13(2,3)4)7-12(15-14)11-5-6-16-9-11/h10-12,15H,5-9,14H2,1-4H3
InChIKeyFFKDWNXUJICROR-UHFFFAOYSA-N
XLogP2.32
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.32
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

(1-cyclohexyl-3,5,5-trimethylhexyl)hydrazine
CID 105282017
[3-cyclopropyl-3-methyl-1-(oxolan-3-yl)butyl]hydrazine
CID 165350665
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3,5,5-trimethylhexyl]hydrazine
CID 105325560
[3-ethyl-1-(oxolan-3-yl)pentyl]hydrazine
CID 105229503
[3-methyl-1-(oxan-3-yl)pentyl]hydrazine
CID 105230031
[4-methoxy-3-methyl-1-(oxan-3-yl)butyl]hydrazine
CID 107139950
[4-methoxy-4-methyl-1-(oxolan-3-yl)pentyl]hydrazine
CID 103026580
[3-ethyl-1-(oxan-3-yl)pentyl]hydrazine
CID 105230093
[3-methylidene-1-(oxolan-3-yl)pentyl]hydrazine
CID 105229484
[1-(oxolan-3-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217487
[4-methylsulfonyl-1-(oxolan-3-yl)butyl]hydrazine
CID 105229315
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N,3,5,5-tetramethylhexan-1-amine
CID 105017181

Frequently Asked Questions

What is the IUPAC name of [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine?
The IUPAC name of [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine (CID 105306512) is [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine.
What is the SMILES notation for [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine?
The canonical SMILES for [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine is CC(CC(NN)C1CCOC1)CC(C)(C)C.
What is the InChIKey of [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine?
The InChIKey is FFKDWNXUJICROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-10(8-13(2,3)4)7-12(15-14)11-5-6-16-9-11/h10-12,15H,5-9,14H2,1-4H3.
What are the key properties of [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine?
[3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine has a molecular weight of 228.38 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5,5-trimethyl-1-(oxolan-3-yl)hexyl]hydrazine is sourced from PubChem (CID 105306512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).