cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane

C11H22NO2PS — CID 590476

IUPACcyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane
SMILESCOP(=S)(C1CCCCC1)N1CCOCC1
InChIInChI=1S/C11H22NO2PS/c1-13-15(16,11-5-3-2-4-6-11)12-7-9-14-10-8-12/h11H,2-10H2,1H3
InChIKeyCRSKNXXAIIDTQZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.61
Rot. Bonds3

About cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane

cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane (PubChem CID 590476) has the molecular formula C11H22NO2PS and a molecular weight of 263.34 g/mol. Its IUPAC name is cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane.

Molecular Properties

Compound Namecyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane
PubChem CID590476
Molecular FormulaC11H22NO2PS
Molecular Weight263.34 g/mol
Exact Mass263.11
IUPAC Namecyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane
SMILESCOP(=S)(C1CCCCC1)N1CCOCC1
InChIInChI=1S/C11H22NO2PS/c1-13-15(16,11-5-3-2-4-6-11)12-7-9-14-10-8-12/h11H,2-10H2,1H3
InChIKeyCRSKNXXAIIDTQZ-UHFFFAOYSA-N
XLogP2.61
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane?
The IUPAC name of cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane (CID 590476) is cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane.
What is the SMILES notation for cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane?
The canonical SMILES for cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane is COP(=S)(C1CCCCC1)N1CCOCC1.
What is the InChIKey of cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane?
The InChIKey is CRSKNXXAIIDTQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22NO2PS/c1-13-15(16,11-5-3-2-4-6-11)12-7-9-14-10-8-12/h11H,2-10H2,1H3.
What are the key properties of cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane?
cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane has a molecular weight of 263.34 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-methoxy-morpholin-4-yl-sulfanylidene-lambda5-phosphane is sourced from PubChem (CID 590476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).