(3-methoxy-3-methylnon-7-yn-4-yl)hydrazine

C11H22N2O — CID 105274497

IUPAC(3-methoxy-3-methylnon-7-yn-4-yl)hydrazine
SMILESCC#CCCC(NN)C(C)(CC)OC
InChIInChI=1S/C11H22N2O/c1-5-7-8-9-10(13-12)11(3,6-2)14-4/h10,13H,6,8-9,12H2,1-4H3
InChIKeySYJLBZDGJSHTOP-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.44
Rot. Bonds6

About (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine

(3-methoxy-3-methylnon-7-yn-4-yl)hydrazine (PubChem CID 105274497) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine.

Molecular Properties

Compound Name(3-methoxy-3-methylnon-7-yn-4-yl)hydrazine
PubChem CID105274497
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(3-methoxy-3-methylnon-7-yn-4-yl)hydrazine
SMILESCC#CCCC(NN)C(C)(CC)OC
InChIInChI=1S/C11H22N2O/c1-5-7-8-9-10(13-12)11(3,6-2)14-4/h10,13H,6,8-9,12H2,1-4H3
InChIKeySYJLBZDGJSHTOP-UHFFFAOYSA-N
XLogP1.44
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.44
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 (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine?
The IUPAC name of (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine (CID 105274497) is (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine.
What is the SMILES notation for (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine?
The canonical SMILES for (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine is CC#CCCC(NN)C(C)(CC)OC.
What is the InChIKey of (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine?
The InChIKey is SYJLBZDGJSHTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-7-8-9-10(13-12)11(3,6-2)14-4/h10,13H,6,8-9,12H2,1-4H3.
What are the key properties of (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine?
(3-methoxy-3-methylnon-7-yn-4-yl)hydrazine has a molecular weight of 198.31 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-3-methylnon-7-yn-4-yl)hydrazine is sourced from PubChem (CID 105274497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).