1-(1-diethoxysilylbutan-2-ylamino)ethanol

C10H25NO3Si — CID 173029287

IUPAC1-(1-diethoxysilylbutan-2-ylamino)ethanol
SMILESCCO[SiH](CC(CC)NC(C)O)OCC
InChIInChI=1S/C10H25NO3Si/c1-5-10(11-9(4)12)8-15(13-6-2)14-7-3/h9-12,15H,5-8H2,1-4H3
InChIKeyXRYFZQZLCWIOGG-UHFFFAOYSA-N
MW235.40 g/mol
LogP0.99
Rot. Bonds9

About 1-(1-diethoxysilylbutan-2-ylamino)ethanol

1-(1-diethoxysilylbutan-2-ylamino)ethanol (PubChem CID 173029287) has the molecular formula C10H25NO3Si and a molecular weight of 235.40 g/mol. Its IUPAC name is 1-(1-diethoxysilylbutan-2-ylamino)ethanol.

Molecular Properties

Compound Name1-(1-diethoxysilylbutan-2-ylamino)ethanol
PubChem CID173029287
Molecular FormulaC10H25NO3Si
Molecular Weight235.40 g/mol
Exact Mass235.16
IUPAC Name1-(1-diethoxysilylbutan-2-ylamino)ethanol
SMILESCCO[SiH](CC(CC)NC(C)O)OCC
InChIInChI=1S/C10H25NO3Si/c1-5-10(11-9(4)12)8-15(13-6-2)14-7-3/h9-12,15H,5-8H2,1-4H3
InChIKeyXRYFZQZLCWIOGG-UHFFFAOYSA-N
XLogP0.99
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(pentan-3-ylamino)ethanol
CID 18004281
N'-(1-diethoxysilylbutan-2-yl)ethane-1,2-diamine
CID 173106789
1-(1-ethoxyethylamino)ethanol
CID 18004306
N-diethoxysilylpentan-3-amine
CID 174620247
2-diethoxysilyl-1-N'-ethylethane-1,1-diamine
CID 173004236
(1S)-1-[[(1S)-1-hydroxyethyl]amino]ethanol
CID 93481820
1-(1-hydroxyethylamino)ethanol
CID 18183743
1-[1-(pentan-3-ylamino)ethoxy]ethanol
CID 174943927
N-[butan-2-yl(ethoxy)silyl]ethanamine
CID 150000998
1-(1-hydroxyethylamino)ethanol;hydrochloride
CID 57449436
1-(1-hydroxyethylamino)ethanol;hydrobromide
CID 173051488
(1R)-1-[[2-(ethoxyamino)-2,6-dimethylheptan-4-yl]amino]ethanol
CID 143602754

Frequently Asked Questions

What is the IUPAC name of 1-(1-diethoxysilylbutan-2-ylamino)ethanol?
The IUPAC name of 1-(1-diethoxysilylbutan-2-ylamino)ethanol (CID 173029287) is 1-(1-diethoxysilylbutan-2-ylamino)ethanol.
What is the SMILES notation for 1-(1-diethoxysilylbutan-2-ylamino)ethanol?
The canonical SMILES for 1-(1-diethoxysilylbutan-2-ylamino)ethanol is CCO[SiH](CC(CC)NC(C)O)OCC.
What is the InChIKey of 1-(1-diethoxysilylbutan-2-ylamino)ethanol?
The InChIKey is XRYFZQZLCWIOGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO3Si/c1-5-10(11-9(4)12)8-15(13-6-2)14-7-3/h9-12,15H,5-8H2,1-4H3.
What are the key properties of 1-(1-diethoxysilylbutan-2-ylamino)ethanol?
1-(1-diethoxysilylbutan-2-ylamino)ethanol has a molecular weight of 235.40 g/mol, XLogP of 0.99, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-diethoxysilylbutan-2-ylamino)ethanol is sourced from PubChem (CID 173029287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).