[1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine

C10H16N2O2S — CID 102843367

IUPAC[1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCc1sccc1C(NN)C1COCCO1
InChIInChI=1S/C10H16N2O2S/c1-7-8(2-5-15-7)10(12-11)9-6-13-3-4-14-9/h2,5,9-10,12H,3-4,6,11H2,1H3
InChIKeyFKGPUWXYJWENDK-UHFFFAOYSA-N
MW228.32 g/mol
LogP0.98
Rot. Bonds3

About [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine

[1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine (PubChem CID 102843367) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine
PubChem CID102843367
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name[1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCc1sccc1C(NN)C1COCCO1
InChIInChI=1S/C10H16N2O2S/c1-7-8(2-5-15-7)10(12-11)9-6-13-3-4-14-9/h2,5,9-10,12H,3-4,6,11H2,1H3
InChIKeyFKGPUWXYJWENDK-UHFFFAOYSA-N
XLogP0.98
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[1,4-dioxan-2-yl-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105302410
[1,4-dioxan-2-yl(naphthalen-1-yl)methyl]hydrazine
CID 105301200
[1,4-dioxan-2-yl(furan-2-yl)methyl]hydrazine
CID 105305979
[1,4-dioxan-2-yl-(4-propylphenyl)methyl]hydrazine
CID 105303764
[1,4-dioxan-2-yl-(3-fluorophenyl)methyl]hydrazine
CID 105285493
[7-bicyclo[4.2.0]octa-1,3,5-trienyl-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102842792
N-methyl-1-(3-methyloxolan-2-yl)-1-(2-methylthiophen-3-yl)methanamine
CID 102840428
[(4-methylthiomorpholin-3-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 106446271
[(2-methylthiophen-3-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 102842760
[1-(2-methylthiophen-3-yl)-3-(oxan-2-yl)propyl]hydrazine
CID 102843428
1-(1,4-dioxan-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 115825359
1-(2,5-dimethylfuran-3-yl)-1-(1,4-dioxan-2-yl)-N-methylmethanamine
CID 62805801

Frequently Asked Questions

What is the IUPAC name of [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine?
The IUPAC name of [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine (CID 102843367) is [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine is Cc1sccc1C(NN)C1COCCO1.
What is the InChIKey of [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine?
The InChIKey is FKGPUWXYJWENDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-7-8(2-5-15-7)10(12-11)9-6-13-3-4-14-9/h2,5,9-10,12H,3-4,6,11H2,1H3.
What are the key properties of [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine?
[1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine has a molecular weight of 228.32 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1,4-dioxan-2-yl-(2-methylthiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 102843367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).