4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine

C18H30N2O2Te — CID 11015580

IUPAC4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine
SMILESCCCC[Te]/C(=C\C#CCN1CCOCC1)CN1CCOCC1
InChIInChI=1S/C18H30N2O2Te/c1-2-3-16-23-18(17-20-10-14-22-15-11-20)6-4-5-7-19-8-12-21-13-9-19/h6H,2-3,7-17H2,1H3/b18-6-
InChIKeyNEHRMVIOPIMMSG-FXBPXSCXSA-N
MW434.05 g/mol
LogP1.46
Rot. Bonds7

About 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine

4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine (PubChem CID 11015580) has the molecular formula C18H30N2O2Te and a molecular weight of 434.05 g/mol. Its IUPAC name is 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine.

Molecular Properties

Compound Name4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine
PubChem CID11015580
Molecular FormulaC18H30N2O2Te
Molecular Weight434.05 g/mol
Exact Mass436.14
IUPAC Name4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine
SMILESCCCC[Te]/C(=C\C#CCN1CCOCC1)CN1CCOCC1
InChIInChI=1S/C18H30N2O2Te/c1-2-3-16-23-18(17-20-10-14-22-15-11-20)6-4-5-7-19-8-12-21-13-9-19/h6H,2-3,7-17H2,1H3/b18-6-
InChIKeyNEHRMVIOPIMMSG-FXBPXSCXSA-N
XLogP1.46
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.05
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine?
The IUPAC name of 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine (CID 11015580) is 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine.
What is the SMILES notation for 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine?
The canonical SMILES for 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine is CCCC[Te]/C(=C\C#CCN1CCOCC1)CN1CCOCC1.
What is the InChIKey of 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine?
The InChIKey is NEHRMVIOPIMMSG-FXBPXSCXSA-N. The full InChI is InChI=1S/C18H30N2O2Te/c1-2-3-16-23-18(17-20-10-14-22-15-11-20)6-4-5-7-19-8-12-21-13-9-19/h6H,2-3,7-17H2,1H3/b18-6-.
What are the key properties of 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine?
4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine has a molecular weight of 434.05 g/mol, XLogP of 1.46, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-butyltellanyl-6-morpholin-4-ylhex-2-en-4-ynyl]morpholine is sourced from PubChem (CID 11015580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).