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

C12H24N2O — CID 105274834

IUPAC(3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine
SMILESCC#CCCC(NN)C(C)(CC)OCC
InChIInChI=1S/C12H24N2O/c1-5-8-9-10-11(14-13)12(4,6-2)15-7-3/h11,14H,6-7,9-10,13H2,1-4H3
InChIKeyDQXHRLOJDFPCSA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.83
Rot. Bonds7

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

(3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine (PubChem CID 105274834) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine.

Molecular Properties

Compound Name(3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine
PubChem CID105274834
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine
SMILESCC#CCCC(NN)C(C)(CC)OCC
InChIInChI=1S/C12H24N2O/c1-5-8-9-10-11(14-13)12(4,6-2)15-7-3/h11,14H,6-7,9-10,13H2,1-4H3
InChIKeyDQXHRLOJDFPCSA-UHFFFAOYSA-N
XLogP1.83
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.83
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

(5-Ethoxy-1,1,1-trifluoro-5-methylheptan-4-yl)hydrazine
CID 105274628
(5-Ethoxy-5-ethyl-1,1,1-trifluoroheptan-4-yl)hydrazine
CID 105274961
1-(4-Methylhexan-3-yl)-2-[2-methyl-2-(3-methylbutoxy)propyl]hydrazine
CID 90906138
1-(4-Methylhexan-3-yl)-2-[2-methyl-2-(3-methylpentoxy)propyl]hydrazine
CID 91360725
(6-Methoxy-6-methylhept-1-yn-4-yl)hydrazine
CID 103025160
(2-Methoxy-2-methyloct-6-yn-4-yl)hydrazine
CID 103025215
(2-Methoxy-2-methylnon-7-yn-4-yl)hydrazine
CID 103025479
(2-Ethoxy-5-methylhexan-3-yl)hydrazine
CID 105222684
(2-Ethoxy-4-ethylhexan-3-yl)hydrazine
CID 105222687
2-Ethoxyhept-6-yn-3-ylhydrazine
CID 105222839
2-Ethoxyoct-6-yn-3-ylhydrazine
CID 105222915
(2-Ethoxy-5-methylheptan-3-yl)hydrazine
CID 105222934

Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine?
The IUPAC name of (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine (CID 105274834) is (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine.
What is the SMILES notation for (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine?
The canonical SMILES for (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine is CC#CCCC(NN)C(C)(CC)OCC.
What is the InChIKey of (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine?
The InChIKey is DQXHRLOJDFPCSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-5-8-9-10-11(14-13)12(4,6-2)15-7-3/h11,14H,6-7,9-10,13H2,1-4H3.
What are the key properties of (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine?
(3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine has a molecular weight of 212.34 g/mol, XLogP of 1.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-3-methylnon-7-yn-4-yl)hydrazine is sourced from PubChem (CID 105274834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).