(3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine

C11H22N2O — CID 105273383

IUPAC(3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine
SMILESCC#CCC(NN)C(OC)C(C)(C)C
InChIInChI=1S/C11H22N2O/c1-6-7-8-9(13-12)10(14-5)11(2,3)4/h9-10,13H,8,12H2,1-5H3
InChIKeyFDCNEJJGVVTGEX-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.29
Rot. Bonds4

About (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine

(3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine (PubChem CID 105273383) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine.

Molecular Properties

Compound Name(3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine
PubChem CID105273383
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine
SMILESCC#CCC(NN)C(OC)C(C)(C)C
InChIInChI=1S/C11H22N2O/c1-6-7-8-9(13-12)10(14-5)11(2,3)4/h9-10,13H,8,12H2,1-5H3
InChIKeyFDCNEJJGVVTGEX-UHFFFAOYSA-N
XLogP1.29
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.29
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(1-Methoxy-4,4-dimethylpentan-2-yl)hydrazine
CID 105220429
(4,4-Dimethyl-1-propan-2-yloxypentan-2-yl)hydrazine
CID 105220468
(2-Ethoxy-5-methylhexan-3-yl)hydrazine
CID 105222684
2-Ethoxyhept-6-yn-3-ylhydrazine
CID 105222839
2-Ethoxyoct-6-yn-3-ylhydrazine
CID 105222915
(4-Ethoxy-2,2-dimethylpentan-3-yl)hydrazine
CID 105222967
(2-Methoxy-2-methylhept-5-yn-3-yl)hydrazine
CID 105245313
(2-Methoxy-2-methylhept-6-yn-3-yl)hydrazine
CID 105245367
(2-Methoxy-2-methyloct-6-yn-3-yl)hydrazine
CID 105245441
(2-Methoxy-5-methylhexan-3-yl)hydrazine
CID 105246780
(4-Ethyl-2-methoxyhexan-3-yl)hydrazine
CID 105246783
2-Methoxyhept-5-yn-3-ylhydrazine
CID 105246883

Frequently Asked Questions

What is the IUPAC name of (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine?
The IUPAC name of (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine (CID 105273383) is (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine.
What is the SMILES notation for (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine?
The canonical SMILES for (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine is CC#CCC(NN)C(OC)C(C)(C)C.
What is the InChIKey of (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine?
The InChIKey is FDCNEJJGVVTGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-6-7-8-9(13-12)10(14-5)11(2,3)4/h9-10,13H,8,12H2,1-5H3.
What are the key properties of (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine?
(3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine has a molecular weight of 198.31 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-2,2-dimethyloct-6-yn-4-yl)hydrazine is sourced from PubChem (CID 105273383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).