1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol

C18H41NO3Si2 — CID 59758711

IUPAC1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol
SMILESC[Si](C)(C)CC[Si](C)(C)CCCOCC(O)CNCC1CCCO1
InChIInChI=1S/C18H41NO3Si2/c1-23(2,3)12-13-24(4,5)11-7-9-21-16-17(20)14-19-15-18-8-6-10-22-18/h17-20H,6-16H2,1-5H3
InChIKeyWNXVEPORINZWHE-UHFFFAOYSA-N
MW375.70 g/mol
LogP3.57
Rot. Bonds13

About 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol

1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol (PubChem CID 59758711) has the molecular formula C18H41NO3Si2 and a molecular weight of 375.70 g/mol. Its IUPAC name is 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol.

Molecular Properties

Compound Name1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol
PubChem CID59758711
Molecular FormulaC18H41NO3Si2
Molecular Weight375.70 g/mol
Exact Mass375.26
IUPAC Name1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol
SMILESC[Si](C)(C)CC[Si](C)(C)CCCOCC(O)CNCC1CCCO1
InChIInChI=1S/C18H41NO3Si2/c1-23(2,3)12-13-24(4,5)11-7-9-21-16-17(20)14-19-15-18-8-6-10-22-18/h17-20H,6-16H2,1-5H3
InChIKeyWNXVEPORINZWHE-UHFFFAOYSA-N
XLogP3.57
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.70
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[(2-methylpropan-2-yl)oxy]-3-(oxolan-2-ylmethylamino)propan-2-ol
CID 60634018
1-cyclohexyloxy-3-(oxolan-2-ylmethylamino)propan-2-ol
CID 60633578
1-(3-ethoxypropylamino)-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 60634131
1-methoxy-3-[2-(oxolan-2-yl)ethylamino]propan-2-ol
CID 63928603
1-[(1-methylpyrrolidin-2-yl)methylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 106025608
1-[(4-methylmorpholin-2-yl)methylamino]-3-(4-methylpentoxy)propan-2-ol
CID 78945233
3-(2,2-difluoroethoxy)-N-(oxolan-2-ylmethyl)propan-1-amine
CID 103208032
1-(3-methoxyphenoxy)-3-(oxolan-2-ylmethylamino)propan-2-ol
CID 60633751
1-(oxan-2-ylmethylamino)-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 55014565
1-[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 106372856
(2R)-1-[2-(2-hydroxyethoxy)ethylamino]-3-[[(2S)-oxolan-2-yl]methoxy]propan-2-ol
CID 94562031
methyl 4-[(2R)-2-hydroxy-3-[[(2S)-oxolan-2-yl]methylamino]propoxy]-3-methoxybenzoate
CID 8002711

Frequently Asked Questions

What is the IUPAC name of 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol?
The IUPAC name of 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol (CID 59758711) is 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol.
What is the SMILES notation for 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol?
The canonical SMILES for 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol is C[Si](C)(C)CC[Si](C)(C)CCCOCC(O)CNCC1CCCO1.
What is the InChIKey of 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol?
The InChIKey is WNXVEPORINZWHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H41NO3Si2/c1-23(2,3)12-13-24(4,5)11-7-9-21-16-17(20)14-19-15-18-8-6-10-22-18/h17-20H,6-16H2,1-5H3.
What are the key properties of 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol?
1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol has a molecular weight of 375.70 g/mol, XLogP of 3.57, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[dimethyl(2-trimethylsilylethyl)silyl]propoxy]-3-(oxolan-2-ylmethylamino)propan-2-ol is sourced from PubChem (CID 59758711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).