2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane

C21H43NO2Si — CID 10619114

IUPAC2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane
SMILESCCC[C@]1(N2CCOCC2)C[C@H]1CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C21H43NO2Si/c1-8-10-21(22-11-14-23-15-12-22)16-20(21)9-13-24-25(17(2)3,18(4)5)19(6)7/h17-20H,8-16H2,1-7H3/t20-,21+/m1/s1
InChIKeyXNGOYHPOYYKGRB-RTWAWAEBSA-N
MW369.67 g/mol
LogP5.46
Rot. Bonds10

About 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane

2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane (PubChem CID 10619114) has the molecular formula C21H43NO2Si and a molecular weight of 369.67 g/mol. Its IUPAC name is 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane
PubChem CID10619114
Molecular FormulaC21H43NO2Si
Molecular Weight369.67 g/mol
Exact Mass369.31
IUPAC Name2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane
SMILESCCC[C@]1(N2CCOCC2)C[C@H]1CCO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C21H43NO2Si/c1-8-10-21(22-11-14-23-15-12-22)16-20(21)9-13-24-25(17(2)3,18(4)5)19(6)7/h17-20H,8-16H2,1-7H3/t20-,21+/m1/s1
InChIKeyXNGOYHPOYYKGRB-RTWAWAEBSA-N
XLogP5.46
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.67
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane?
The IUPAC name of 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane (CID 10619114) is 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane?
The canonical SMILES for 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane is CCC[C@]1(N2CCOCC2)C[C@H]1CCO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane?
The InChIKey is XNGOYHPOYYKGRB-RTWAWAEBSA-N. The full InChI is InChI=1S/C21H43NO2Si/c1-8-10-21(22-11-14-23-15-12-22)16-20(21)9-13-24-25(17(2)3,18(4)5)19(6)7/h17-20H,8-16H2,1-7H3/t20-,21+/m1/s1.
What are the key properties of 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane?
2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane has a molecular weight of 369.67 g/mol, XLogP of 5.46, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S,2S)-2-morpholin-4-yl-2-propylcyclopropyl]ethoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 10619114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).