1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane

C8H22N2OSi — CID 173050421

IUPAC1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane
SMILESCC(C)O[SiH3].CC(N)C1CNC1
InChIInChI=1S/C5H12N2.C3H10OSi/c1-4(6)5-2-7-3-5;1-3(2)4-5/h4-5,7H,2-3,6H2,1H3;3H,1-2,5H3
InChIKeyBFIFFSWEFYWLML-UHFFFAOYSA-N
MW190.36 g/mol
LogP-0.76
Rot. Bonds2

About 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane

1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane (PubChem CID 173050421) has the molecular formula C8H22N2OSi and a molecular weight of 190.36 g/mol. Its IUPAC name is 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane.

Molecular Properties

Compound Name1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane
PubChem CID173050421
Molecular FormulaC8H22N2OSi
Molecular Weight190.36 g/mol
Exact Mass190.15
IUPAC Name1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane
SMILESCC(C)O[SiH3].CC(N)C1CNC1
InChIInChI=1S/C5H12N2.C3H10OSi/c1-4(6)5-2-7-3-5;1-3(2)4-5/h4-5,7H,2-3,6H2,1H3;3H,1-2,5H3
InChIKeyBFIFFSWEFYWLML-UHFFFAOYSA-N
XLogP-0.76
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(1S)-1-(azetidin-3-yl)ethanamine
CID 96955547
1-(azetidin-3-yl)ethanamine;diethoxymethylsilane
CID 173107228
1-(azetidin-3-yl)ethanethiol
CID 123520363
propan-2-yloxysilane;hydrochloride
CID 174499171
1-(azetidin-3-yl)-3-methylbutan-1-amine
CID 116935262
1-cyclopropylethanamine
CID 519239
3-(1-bromoethyl)azetidine
CID 167740275
1-pyrrolidin-3-ylethanamine;triethoxysilane
CID 173046931
1-(4-fluoropyrrolidin-3-yl)ethanamine
CID 57015274
1-(azetidin-3-yl)ethanol;hydrochloride
CID 118703436
1-[3-(1-aminoethyl)cyclopentyl]ethanamine
CID 68748757
1-(azacyclododec-3-yl)ethanamine;tripropoxysilane
CID 173123595

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane?
The IUPAC name of 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane (CID 173050421) is 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane.
What is the SMILES notation for 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane?
The canonical SMILES for 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane is CC(C)O[SiH3].CC(N)C1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane?
The InChIKey is BFIFFSWEFYWLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2.C3H10OSi/c1-4(6)5-2-7-3-5;1-3(2)4-5/h4-5,7H,2-3,6H2,1H3;3H,1-2,5H3.
What are the key properties of 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane?
1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane has a molecular weight of 190.36 g/mol, XLogP of -0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)ethanamine;propan-2-yloxysilane is sourced from PubChem (CID 173050421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).