1-(1,4-oxathian-2-yl)propylhydrazine

C7H16N2OS — CID 105249656

IUPAC1-(1,4-oxathian-2-yl)propylhydrazine
SMILESCCC(NN)C1CSCCO1
InChIInChI=1S/C7H16N2OS/c1-2-6(9-8)7-5-11-4-3-10-7/h6-7,9H,2-5,8H2,1H3
InChIKeyOLPWHXZCLILMEA-UHFFFAOYSA-N
MW176.28 g/mol
LogP0.36
Rot. Bonds3

About 1-(1,4-oxathian-2-yl)propylhydrazine

1-(1,4-oxathian-2-yl)propylhydrazine (PubChem CID 105249656) has the molecular formula C7H16N2OS and a molecular weight of 176.28 g/mol. Its IUPAC name is 1-(1,4-oxathian-2-yl)propylhydrazine.

Molecular Properties

Compound Name1-(1,4-oxathian-2-yl)propylhydrazine
PubChem CID105249656
Molecular FormulaC7H16N2OS
Molecular Weight176.28 g/mol
Exact Mass176.10
IUPAC Name1-(1,4-oxathian-2-yl)propylhydrazine
SMILESCCC(NN)C1CSCCO1
InChIInChI=1S/C7H16N2OS/c1-2-6(9-8)7-5-11-4-3-10-7/h6-7,9H,2-5,8H2,1H3
InChIKeyOLPWHXZCLILMEA-UHFFFAOYSA-N
XLogP0.36
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.28
LogP ≤ 50.36
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

[3-methyl-1-(1,4-oxathian-2-yl)pentyl]hydrazine
CID 105249722
[3-methyl-1-(1,4-oxathian-2-yl)butyl]hydrazine
CID 105249480
1-(1,4-oxathian-2-yl)heptylhydrazine
CID 105249713
[3-methylidene-1-(1,4-oxathian-2-yl)pentyl]hydrazine
CID 105249763
(1S)-1-(1,4-oxathian-2-yl)propan-1-amine
CID 104932260
[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249582
[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine
CID 105249482
1-(1,4-oxathian-2-yl)pent-4-enylhydrazine
CID 105249626
N,3-diethyl-1-(1,4-oxathian-2-yl)pentan-1-amine
CID 82922082
[1-(1,4-oxathian-2-yl)-2-thiophen-2-ylethyl]hydrazine
CID 105249760
[2-(5-ethyl-2-pyridinyl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249552
[2-(4-bromothiophen-2-yl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249744

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-oxathian-2-yl)propylhydrazine?
The IUPAC name of 1-(1,4-oxathian-2-yl)propylhydrazine (CID 105249656) is 1-(1,4-oxathian-2-yl)propylhydrazine.
What is the SMILES notation for 1-(1,4-oxathian-2-yl)propylhydrazine?
The canonical SMILES for 1-(1,4-oxathian-2-yl)propylhydrazine is CCC(NN)C1CSCCO1.
What is the InChIKey of 1-(1,4-oxathian-2-yl)propylhydrazine?
The InChIKey is OLPWHXZCLILMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2OS/c1-2-6(9-8)7-5-11-4-3-10-7/h6-7,9H,2-5,8H2,1H3.
What are the key properties of 1-(1,4-oxathian-2-yl)propylhydrazine?
1-(1,4-oxathian-2-yl)propylhydrazine has a molecular weight of 176.28 g/mol, XLogP of 0.36, 3 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)propylhydrazine is sourced from PubChem (CID 105249656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).