[4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine

C11H24N2OS — CID 103026447

IUPAC[4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)C1CCSC1
InChIInChI=1S/C11H24N2OS/c1-11(2,14-3)6-4-10(13-12)9-5-7-15-8-9/h9-10,13H,4-8,12H2,1-3H3
InChIKeyLUPWEGVTNQGQPW-UHFFFAOYSA-N
MW232.39 g/mol
LogP1.78
Rot. Bonds6

About [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine

[4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine (PubChem CID 103026447) has the molecular formula C11H24N2OS and a molecular weight of 232.39 g/mol. Its IUPAC name is [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine
PubChem CID103026447
Molecular FormulaC11H24N2OS
Molecular Weight232.39 g/mol
Exact Mass232.16
IUPAC Name[4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)C1CCSC1
InChIInChI=1S/C11H24N2OS/c1-11(2,14-3)6-4-10(13-12)9-5-7-15-8-9/h9-10,13H,4-8,12H2,1-3H3
InChIKeyLUPWEGVTNQGQPW-UHFFFAOYSA-N
XLogP1.78
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.39
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[4-methyl-1-(thiolan-3-yl)pentyl]hydrazine
CID 105294315
[4-methoxy-4-methyl-1-(oxolan-3-yl)pentyl]hydrazine
CID 103026580
[2-propan-2-yloxy-1-(thiolan-3-yl)ethyl]hydrazine
CID 105323843
(1-cyclopropyl-4,4-dimethylpentyl)hydrazine
CID 105202500
1-(thiolan-3-yl)hex-5-ynylhydrazine
CID 105333543
[4-methoxy-4-methyl-1-(oxolan-2-yl)pentyl]hydrazine
CID 103026331
1-(4-ethylcyclohexyl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103035720
1-(1,4-dithian-2-yl)-4-methoxy-4-methylpentan-1-amine
CID 103035921
1-cyclobutyl-N-ethyl-4-methoxy-4-methylpentan-1-amine
CID 103032134
1-cyclohexyl-5-methoxy-5-methylhexan-2-amine
CID 103031159
[5,5-dimethyl-1-(4-propan-2-ylcyclohexyl)hexyl]hydrazine
CID 114211474
(6-methoxy-2,2,6-trimethylheptan-3-yl)hydrazine
CID 103026262

Frequently Asked Questions

What is the IUPAC name of [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine?
The IUPAC name of [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine (CID 103026447) is [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine.
What is the SMILES notation for [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine?
The canonical SMILES for [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine is COC(C)(C)CCC(NN)C1CCSC1.
What is the InChIKey of [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine?
The InChIKey is LUPWEGVTNQGQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2OS/c1-11(2,14-3)6-4-10(13-12)9-5-7-15-8-9/h9-10,13H,4-8,12H2,1-3H3.
What are the key properties of [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine?
[4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine has a molecular weight of 232.39 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-4-methyl-1-(thiolan-3-yl)pentyl]hydrazine is sourced from PubChem (CID 103026447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).