(5-methoxy-5-methylhex-1-yn-3-yl)hydrazine

C8H16N2O — CID 103025365

IUPAC(5-methoxy-5-methylhex-1-yn-3-yl)hydrazine
SMILESC#CC(CC(C)(C)OC)NN
InChIInChI=1S/C8H16N2O/c1-5-7(10-9)6-8(2,3)11-4/h1,7,10H,6,9H2,2-4H3
InChIKeyJPEDITNVGKVEQN-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.27
Rot. Bonds4

About (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine

(5-methoxy-5-methylhex-1-yn-3-yl)hydrazine (PubChem CID 103025365) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine.

Molecular Properties

Compound Name(5-methoxy-5-methylhex-1-yn-3-yl)hydrazine
PubChem CID103025365
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(5-methoxy-5-methylhex-1-yn-3-yl)hydrazine
SMILESC#CC(CC(C)(C)OC)NN
InChIInChI=1S/C8H16N2O/c1-5-7(10-9)6-8(2,3)11-4/h1,7,10H,6,9H2,2-4H3
InChIKeyJPEDITNVGKVEQN-UHFFFAOYSA-N
XLogP0.27
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.27
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

[(2R)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 29014952
[(2S)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 29014954
(4-Methoxy-4-methylpentan-2-yl)hydrazine
CID 43147267
(4-Methoxy-4-methylpentan-2-yl)hydrazine hydrochloride
CID 45791435
(4-Methoxy-4-methylpentan-2-yl)hydrazine dihydrochloride
CID 45791442
2-(4-Methoxy-4-methylpentan-2-yl)-1,1-dimethylhydrazine
CID 83003419
(6-Methoxy-6-methylhept-1-yn-4-yl)hydrazine
CID 103025160
(5-Methoxy-2,5-dimethylhexan-3-yl)hydrazine
CID 103025161
(5-Methoxy-5-methylhexan-3-yl)hydrazine
CID 103025162
(2-Methoxy-2-methyloct-6-yn-4-yl)hydrazine
CID 103025215
(2-Methoxy-2-methyloct-7-yn-4-yl)hydrazine
CID 103025321
(2-Methoxy-2-methylnon-8-yn-4-yl)hydrazine
CID 103025470

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine?
The IUPAC name of (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine (CID 103025365) is (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine.
What is the SMILES notation for (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine?
The canonical SMILES for (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine is C#CC(CC(C)(C)OC)NN.
What is the InChIKey of (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine?
The InChIKey is JPEDITNVGKVEQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-5-7(10-9)6-8(2,3)11-4/h1,7,10H,6,9H2,2-4H3.
What are the key properties of (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine?
(5-methoxy-5-methylhex-1-yn-3-yl)hydrazine has a molecular weight of 156.23 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-5-methylhex-1-yn-3-yl)hydrazine is sourced from PubChem (CID 103025365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).