tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane

C18H33NOSi — CID 71479653

IUPACtert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane
SMILESCC(C)(C)[Si](C)(C)C#CC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C18H33NOSi/c1-17(2,3)21(4,5)16-11-18(9-7-6-8-10-18)19-12-14-20-15-13-19/h6-10,12-15H2,1-5H3
InChIKeyAOGMSEPUTUIGNE-UHFFFAOYSA-N
MW307.55 g/mol
LogP4.07
Rot. Bonds1

About tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane

tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane (PubChem CID 71479653) has the molecular formula C18H33NOSi and a molecular weight of 307.55 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane
PubChem CID71479653
Molecular FormulaC18H33NOSi
Molecular Weight307.55 g/mol
Exact Mass307.23
IUPAC Nametert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane
SMILESCC(C)(C)[Si](C)(C)C#CC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C18H33NOSi/c1-17(2,3)21(4,5)16-11-18(9-7-6-8-10-18)19-12-14-20-15-13-19/h6-10,12-15H2,1-5H3
InChIKeyAOGMSEPUTUIGNE-UHFFFAOYSA-N
XLogP4.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.55
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Tert-butyl-dimethyl-[4-(1-morpholin-4-ylcyclohexyl)but-3-ynoxy]silane
CID 132563146
4-(1-Hex-1-ynylcyclohexyl)morpholine
CID 135042994
4-(1-Cyclohexylnon-2-ynyl)morpholine
CID 46184785
N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pent-2-yn-1-amine
CID 131898425
4-(1-Oct-1-ynylcyclohexyl)morpholine
CID 132563144

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane?
The IUPAC name of tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane (CID 71479653) is tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane is CC(C)(C)[Si](C)(C)C#CC1(N2CCOCC2)CCCCC1.
What is the InChIKey of tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane?
The InChIKey is AOGMSEPUTUIGNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33NOSi/c1-17(2,3)21(4,5)16-11-18(9-7-6-8-10-18)19-12-14-20-15-13-19/h6-10,12-15H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane?
tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane has a molecular weight of 307.55 g/mol, XLogP of 4.07, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-(1-morpholin-4-ylcyclohexyl)ethynyl]silane is sourced from PubChem (CID 71479653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).