[2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol

C13H27NO5Si — CID 58444003

IUPAC[2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol
SMILESCO[Si](CO)(CCN(C1CCOC1)C1CCOC1)OC
InChIInChI=1S/C13H27NO5Si/c1-16-20(11-15,17-2)8-5-14(12-3-6-18-9-12)13-4-7-19-10-13/h12-13,15H,3-11H2,1-2H3
InChIKeyNADRGNFCWJUFNH-UHFFFAOYSA-N
MW305.45 g/mol
LogP0.13
Rot. Bonds8

About [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol

[2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol (PubChem CID 58444003) has the molecular formula C13H27NO5Si and a molecular weight of 305.45 g/mol. Its IUPAC name is [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol.

Molecular Properties

Compound Name[2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol
PubChem CID58444003
Molecular FormulaC13H27NO5Si
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name[2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol
SMILESCO[Si](CO)(CCN(C1CCOC1)C1CCOC1)OC
InChIInChI=1S/C13H27NO5Si/c1-16-20(11-15,17-2)8-5-14(12-3-6-18-9-12)13-4-7-19-10-13/h12-13,15H,3-11H2,1-2H3
InChIKeyNADRGNFCWJUFNH-UHFFFAOYSA-N
XLogP0.13
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol?
The IUPAC name of [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol (CID 58444003) is [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol.
What is the SMILES notation for [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol?
The canonical SMILES for [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol is CO[Si](CO)(CCN(C1CCOC1)C1CCOC1)OC.
What is the InChIKey of [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol?
The InChIKey is NADRGNFCWJUFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO5Si/c1-16-20(11-15,17-2)8-5-14(12-3-6-18-9-12)13-4-7-19-10-13/h12-13,15H,3-11H2,1-2H3.
What are the key properties of [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol?
[2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol has a molecular weight of 305.45 g/mol, XLogP of 0.13, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[bis(oxolan-3-yl)amino]ethyl-dimethoxysilyl]methanol is sourced from PubChem (CID 58444003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).