1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol

C15H33NO6Si — CID 90015661

IUPAC1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol
SMILESCO[Si](CCCOCC(O)CN1CC(C)OC(C)C1)(OC)OC
InChIInChI=1S/C15H33NO6Si/c1-13-9-16(10-14(2)22-13)11-15(17)12-21-7-6-8-23(18-3,19-4)20-5/h13-15,17H,6-12H2,1-5H3
InChIKeyQVTOBIXXHDBTEO-UHFFFAOYSA-N
MW351.52 g/mol
LogP0.74
Rot. Bonds11

About 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol

1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol (PubChem CID 90015661) has the molecular formula C15H33NO6Si and a molecular weight of 351.52 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol
PubChem CID90015661
Molecular FormulaC15H33NO6Si
Molecular Weight351.52 g/mol
Exact Mass351.21
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol
SMILESCO[Si](CCCOCC(O)CN1CC(C)OC(C)C1)(OC)OC
InChIInChI=1S/C15H33NO6Si/c1-13-9-16(10-14(2)22-13)11-15(17)12-21-7-6-8-23(18-3,19-4)20-5/h13-15,17H,6-12H2,1-5H3
InChIKeyQVTOBIXXHDBTEO-UHFFFAOYSA-N
XLogP0.74
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.52
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

1,3-bis(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 70522448
(2S)-1-[2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethoxy]-3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 98588160
1-bromo-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 104959987
(2S)-1-[2-(4-chlorophenoxy)ethoxy]-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 7165338
1-(2,6-dimethylmorpholin-4-yl)-3-[2-(3,4-dimethylphenoxy)ethoxy]propan-2-ol
CID 18590100
(2R)-1-[(2,5-dimethoxyphenyl)methoxy]-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 42588329
(2R)-1-[(2,5-dimethoxyphenyl)methoxy]-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 98446984
1-(3-amino-4-methylpyrrolidin-1-yl)-3-butoxypropan-2-ol
CID 107264251
1-(2,6-dimethoxyphenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 3530693
1-methoxypropane;1-methoxy-3-(3-trimethoxysilylpropoxy)propan-2-ol
CID 90896720
1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 78971493
1-(3-trimethoxysilylpropoxy)-3-[2-(3-trimethoxysilylpropylamino)ethylamino]propan-2-ol
CID 20741051

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol (CID 90015661) is 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol is CO[Si](CCCOCC(O)CN1CC(C)OC(C)C1)(OC)OC.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol?
The InChIKey is QVTOBIXXHDBTEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO6Si/c1-13-9-16(10-14(2)22-13)11-15(17)12-21-7-6-8-23(18-3,19-4)20-5/h13-15,17H,6-12H2,1-5H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol?
1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol has a molecular weight of 351.52 g/mol, XLogP of 0.74, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-3-(3-trimethoxysilylpropoxy)propan-2-ol is sourced from PubChem (CID 90015661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).