[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine

C12H18N2OS — CID 105249482

IUPAC[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine
SMILESNNC(Cc1ccccc1)C1CSCCO1
InChIInChI=1S/C12H18N2OS/c13-14-11(12-9-16-7-6-15-12)8-10-4-2-1-3-5-10/h1-5,11-12,14H,6-9,13H2
InChIKeyCAYKKPDYUSHKRP-UHFFFAOYSA-N
MW238.36 g/mol
LogP1.19
Rot. Bonds4

About [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine

[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine (PubChem CID 105249482) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine.

Molecular Properties

Compound Name[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine
PubChem CID105249482
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine
SMILESNNC(Cc1ccccc1)C1CSCCO1
InChIInChI=1S/C12H18N2OS/c13-14-11(12-9-16-7-6-15-12)8-10-4-2-1-3-5-10/h1-5,11-12,14H,6-9,13H2
InChIKeyCAYKKPDYUSHKRP-UHFFFAOYSA-N
XLogP1.19
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 51.19
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

[1-(1,4-oxathian-2-yl)-2-thiophen-2-ylethyl]hydrazine
CID 105249760
1-(1,4-oxathian-2-yl)propylhydrazine
CID 105249656
[2-(3-bromothiophen-2-yl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249733
[2-(4-bromothiophen-2-yl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249744
[2-(1-methylbenzimidazol-2-yl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249700
[2-(5-ethyl-2-pyridinyl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249552
[1-(1,4-oxathian-2-yl)-3-thiophen-3-ylpropyl]hydrazine
CID 105249682
[2-(2-chloro-5-fluorophenyl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 102623389
[3-methyl-1-(1,4-oxathian-2-yl)butyl]hydrazine
CID 105249480
[1-(4-methylthiomorpholin-3-yl)-2-phenylethyl]hydrazine
CID 106446350
[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249582
[1-(1,4-oxathian-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105249781

Frequently Asked Questions

What is the IUPAC name of [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine?
The IUPAC name of [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine (CID 105249482) is [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine.
What is the SMILES notation for [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine?
The canonical SMILES for [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine is NNC(Cc1ccccc1)C1CSCCO1.
What is the InChIKey of [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine?
The InChIKey is CAYKKPDYUSHKRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c13-14-11(12-9-16-7-6-15-12)8-10-4-2-1-3-5-10/h1-5,11-12,14H,6-9,13H2.
What are the key properties of [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine?
[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine has a molecular weight of 238.36 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine is sourced from PubChem (CID 105249482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).