[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine

C14H28N2OS — CID 105341728

IUPAC[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine
SMILESCC1(C)CC(C(NN)C2(C)CCCS2)C(C)(C)O1
InChIInChI=1S/C14H28N2OS/c1-12(2)9-10(13(3,4)17-12)11(16-15)14(5)7-6-8-18-14/h10-11,16H,6-9,15H2,1-5H3
InChIKeyJXTZSLNRJGMNNL-UHFFFAOYSA-N
MW272.46 g/mol
LogP2.70
Rot. Bonds3

About [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine

[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine (PubChem CID 105341728) has the molecular formula C14H28N2OS and a molecular weight of 272.46 g/mol. Its IUPAC name is [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine
PubChem CID105341728
Molecular FormulaC14H28N2OS
Molecular Weight272.46 g/mol
Exact Mass272.19
IUPAC Name[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine
SMILESCC1(C)CC(C(NN)C2(C)CCCS2)C(C)(C)O1
InChIInChI=1S/C14H28N2OS/c1-12(2)9-10(13(3,4)17-12)11(16-15)14(5)7-6-8-18-14/h10-11,16H,6-9,15H2,1-5H3
InChIKeyJXTZSLNRJGMNNL-UHFFFAOYSA-N
XLogP2.70
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 52.70
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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Frequently Asked Questions

What is the IUPAC name of [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine?
The IUPAC name of [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine (CID 105341728) is [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine is CC1(C)CC(C(NN)C2(C)CCCS2)C(C)(C)O1.
What is the InChIKey of [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine?
The InChIKey is JXTZSLNRJGMNNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2OS/c1-12(2)9-10(13(3,4)17-12)11(16-15)14(5)7-6-8-18-14/h10-11,16H,6-9,15H2,1-5H3.
What are the key properties of [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine?
[(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine has a molecular weight of 272.46 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methylthiolan-2-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105341728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).