[5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine

C12H26N2O2 — CID 103025358

IUPAC[5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine
SMILESCOC(C)(C)CC(CCC1CCCO1)NN
InChIInChI=1S/C12H26N2O2/c1-12(2,15-3)9-10(14-13)6-7-11-5-4-8-16-11/h10-11,14H,4-9,13H2,1-3H3
InChIKeyBMIGOTQPRKGOBS-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.59
Rot. Bonds7

About [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine

[5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine (PubChem CID 103025358) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine.

Molecular Properties

Compound Name[5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine
PubChem CID103025358
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name[5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine
SMILESCOC(C)(C)CC(CCC1CCCO1)NN
InChIInChI=1S/C12H26N2O2/c1-12(2,15-3)9-10(14-13)6-7-11-5-4-8-16-11/h10-11,14H,4-9,13H2,1-3H3
InChIKeyBMIGOTQPRKGOBS-UHFFFAOYSA-N
XLogP1.59
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine?
The IUPAC name of [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine (CID 103025358) is [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine.
What is the SMILES notation for [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine?
The canonical SMILES for [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine is COC(C)(C)CC(CCC1CCCO1)NN.
What is the InChIKey of [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine?
The InChIKey is BMIGOTQPRKGOBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-12(2,15-3)9-10(14-13)6-7-11-5-4-8-16-11/h10-11,14H,4-9,13H2,1-3H3.
What are the key properties of [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine?
[5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine has a molecular weight of 230.35 g/mol, XLogP of 1.59, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methoxy-5-methyl-1-(oxolan-2-yl)hexan-3-yl]hydrazine is sourced from PubChem (CID 103025358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).