(2-methoxy-2-methyloct-6-yn-3-yl)hydrazine

C10H20N2O — CID 105245441

IUPAC(2-methoxy-2-methyloct-6-yn-3-yl)hydrazine
SMILESCC#CCCC(NN)C(C)(C)OC
InChIInChI=1S/C10H20N2O/c1-5-6-7-8-9(12-11)10(2,3)13-4/h9,12H,7-8,11H2,1-4H3
InChIKeyMSWHWUZKWSAKCY-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.05
Rot. Bonds5

About (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine

(2-methoxy-2-methyloct-6-yn-3-yl)hydrazine (PubChem CID 105245441) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine.

Molecular Properties

Compound Name(2-methoxy-2-methyloct-6-yn-3-yl)hydrazine
PubChem CID105245441
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(2-methoxy-2-methyloct-6-yn-3-yl)hydrazine
SMILESCC#CCCC(NN)C(C)(C)OC
InChIInChI=1S/C10H20N2O/c1-5-6-7-8-9(12-11)10(2,3)13-4/h9,12H,7-8,11H2,1-4H3
InChIKeyMSWHWUZKWSAKCY-UHFFFAOYSA-N
XLogP1.05
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.05
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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Frequently Asked Questions

What is the IUPAC name of (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine?
The IUPAC name of (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine (CID 105245441) is (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine.
What is the SMILES notation for (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine?
The canonical SMILES for (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine is CC#CCCC(NN)C(C)(C)OC.
What is the InChIKey of (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine?
The InChIKey is MSWHWUZKWSAKCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-5-6-7-8-9(12-11)10(2,3)13-4/h9,12H,7-8,11H2,1-4H3.
What are the key properties of (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine?
(2-methoxy-2-methyloct-6-yn-3-yl)hydrazine has a molecular weight of 184.28 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-2-methyloct-6-yn-3-yl)hydrazine is sourced from PubChem (CID 105245441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).