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

C12H24N2OS — CID 105249582

IUPAC[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCCC1)C1CSCCO1
InChIInChI=1S/C12H24N2OS/c13-14-11(12-9-16-7-6-15-12)8-10-4-2-1-3-5-10/h10-12,14H,1-9,13H2
InChIKeyYXOWHOFTTWQBED-UHFFFAOYSA-N
MW244.40 g/mol
LogP1.92
Rot. Bonds4

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

[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine (PubChem CID 105249582) has the molecular formula C12H24N2OS and a molecular weight of 244.40 g/mol. Its IUPAC name is [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine
PubChem CID105249582
Molecular FormulaC12H24N2OS
Molecular Weight244.40 g/mol
Exact Mass244.16
IUPAC Name[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCCC1)C1CSCCO1
InChIInChI=1S/C12H24N2OS/c13-14-11(12-9-16-7-6-15-12)8-10-4-2-1-3-5-10/h10-12,14H,1-9,13H2
InChIKeyYXOWHOFTTWQBED-UHFFFAOYSA-N
XLogP1.92
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.40
LogP ≤ 51.92
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-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine?
The IUPAC name of [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine (CID 105249582) is [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine is NNC(CC1CCCCC1)C1CSCCO1.
What is the InChIKey of [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine?
The InChIKey is YXOWHOFTTWQBED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2OS/c13-14-11(12-9-16-7-6-15-12)8-10-4-2-1-3-5-10/h10-12,14H,1-9,13H2.
What are the key properties of [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine?
[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine has a molecular weight of 244.40 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105249582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).