2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol

C9H23NO5Si — CID 123986589

IUPAC2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol
SMILESCNCCC[SiH2]OC(OCCO)OCCO
InChIInChI=1S/C9H23NO5Si/c1-10-3-2-8-16-15-9(13-6-4-11)14-7-5-12/h9-12H,2-8,16H2,1H3
InChIKeyKIRUIKIXUCIUFP-UHFFFAOYSA-N
MW253.37 g/mol
LogP-1.58
Rot. Bonds12

About 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol

2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol (PubChem CID 123986589) has the molecular formula C9H23NO5Si and a molecular weight of 253.37 g/mol. Its IUPAC name is 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol.

Molecular Properties

Compound Name2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol
PubChem CID123986589
Molecular FormulaC9H23NO5Si
Molecular Weight253.37 g/mol
Exact Mass253.13
IUPAC Name2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol
SMILESCNCCC[SiH2]OC(OCCO)OCCO
InChIInChI=1S/C9H23NO5Si/c1-10-3-2-8-16-15-9(13-6-4-11)14-7-5-12/h9-12H,2-8,16H2,1H3
InChIKeyKIRUIKIXUCIUFP-UHFFFAOYSA-N
XLogP-1.58
TPSA80.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 5-1.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[2-hydroxyethoxy(propylsilyloxy)methoxy]ethanol
CID 173145253
2-(dipropoxymethoxysilyl)ethanethiol
CID 123916528
2-(2-butoxyethylamino)-2-(2-hydroxyethoxy)ethanol
CID 18945936
3-(2,2-diethoxyethylsilyl)-N-methylpropan-1-amine
CID 154465129
2-[2-[4-[2-[2-(methylamino)ethoxy]ethoxy]butoxy]ethoxy]ethanol
CID 134581965
N-methyl-3-propan-2-yloxypropan-1-amine
CID 19842664
[3-[bis(2-hydroxyethoxy)methoxysilyl]-2-methylpropyl] but-2-enoate
CID 123683062
(Z)-20-[3-hydroxy-1-(2-hydroxyethoxy)propoxy]-1-(methylamino)icos-12-en-4-ol
CID 58066935
N-methyl-N'-[2-(2-propan-2-yloxyethylamino)ethyl]propane-1,3-diamine
CID 149204249
N-ethyl-3-propan-2-yloxysilylpropan-1-amine
CID 173116196
2-[3-(2-hydroxyethoxy)butan-2-yloxy]ethanol
CID 14291300
methanol;N,N',N'-trimethylpropane-1,3-diamine
CID 172587497

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol?
The IUPAC name of 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol (CID 123986589) is 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol.
What is the SMILES notation for 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol?
The canonical SMILES for 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol is CNCCC[SiH2]OC(OCCO)OCCO.
What is the InChIKey of 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol?
The InChIKey is KIRUIKIXUCIUFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO5Si/c1-10-3-2-8-16-15-9(13-6-4-11)14-7-5-12/h9-12H,2-8,16H2,1H3.
What are the key properties of 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol?
2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol has a molecular weight of 253.37 g/mol, XLogP of -1.58, 12 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethoxy-[3-(methylamino)propylsilyloxy]methoxy]ethanol is sourced from PubChem (CID 123986589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).