N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine

C10H23NO4Si — CID 175268788

IUPACN-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine
SMILESC=CCO[Si](O)(OC(C)C)ON(CC)CC
InChIInChI=1S/C10H23NO4Si/c1-6-9-13-16(12,14-10(4)5)15-11(7-2)8-3/h6,10,12H,1,7-9H2,2-5H3
InChIKeyFPTKZNGODRGCDH-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.32
Rot. Bonds9

About N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine

N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine (PubChem CID 175268788) has the molecular formula C10H23NO4Si and a molecular weight of 249.38 g/mol. Its IUPAC name is N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine.

Molecular Properties

Compound NameN-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine
PubChem CID175268788
Molecular FormulaC10H23NO4Si
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC NameN-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine
SMILESC=CCO[Si](O)(OC(C)C)ON(CC)CC
InChIInChI=1S/C10H23NO4Si/c1-6-9-13-16(12,14-10(4)5)15-11(7-2)8-3/h6,10,12H,1,7-9H2,2-5H3
InChIKeyFPTKZNGODRGCDH-UHFFFAOYSA-N
XLogP1.32
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine?
The IUPAC name of N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine (CID 175268788) is N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine.
What is the SMILES notation for N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine?
The canonical SMILES for N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine is C=CCO[Si](O)(OC(C)C)ON(CC)CC.
What is the InChIKey of N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine?
The InChIKey is FPTKZNGODRGCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO4Si/c1-6-9-13-16(12,14-10(4)5)15-11(7-2)8-3/h6,10,12H,1,7-9H2,2-5H3.
What are the key properties of N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine?
N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine has a molecular weight of 249.38 g/mol, XLogP of 1.32, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(hydroxy-propan-2-yloxy-prop-2-enoxysilyl)oxyethanamine is sourced from PubChem (CID 175268788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).