2-(1,1-dimethylsilolan-3-yl)ethanamine

C8H19NSi — CID 122714220

IUPAC2-(1,1-dimethylsilolan-3-yl)ethanamine
SMILESC[Si]1(C)CCC(CCN)C1
InChIInChI=1S/C8H19NSi/c1-10(2)6-4-8(7-10)3-5-9/h8H,3-7,9H2,1-2H3
InChIKeyRJTIZTRROHXZDA-UHFFFAOYSA-N
MW157.33 g/mol
LogP2.06
Rot. Bonds2

About 2-(1,1-dimethylsilolan-3-yl)ethanamine

2-(1,1-dimethylsilolan-3-yl)ethanamine (PubChem CID 122714220) has the molecular formula C8H19NSi and a molecular weight of 157.33 g/mol. Its IUPAC name is 2-(1,1-dimethylsilolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1,1-dimethylsilolan-3-yl)ethanamine
PubChem CID122714220
Molecular FormulaC8H19NSi
Molecular Weight157.33 g/mol
Exact Mass157.13
IUPAC Name2-(1,1-dimethylsilolan-3-yl)ethanamine
SMILESC[Si]1(C)CCC(CCN)C1
InChIInChI=1S/C8H19NSi/c1-10(2)6-4-8(7-10)3-5-9/h8H,3-7,9H2,1-2H3
InChIKeyRJTIZTRROHXZDA-UHFFFAOYSA-N
XLogP2.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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-(1,1-dimethylsilolan-3-yl)ethanamine?
The IUPAC name of 2-(1,1-dimethylsilolan-3-yl)ethanamine (CID 122714220) is 2-(1,1-dimethylsilolan-3-yl)ethanamine.
What is the SMILES notation for 2-(1,1-dimethylsilolan-3-yl)ethanamine?
The canonical SMILES for 2-(1,1-dimethylsilolan-3-yl)ethanamine is C[Si]1(C)CCC(CCN)C1.
What is the InChIKey of 2-(1,1-dimethylsilolan-3-yl)ethanamine?
The InChIKey is RJTIZTRROHXZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NSi/c1-10(2)6-4-8(7-10)3-5-9/h8H,3-7,9H2,1-2H3.
What are the key properties of 2-(1,1-dimethylsilolan-3-yl)ethanamine?
2-(1,1-dimethylsilolan-3-yl)ethanamine has a molecular weight of 157.33 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-dimethylsilolan-3-yl)ethanamine is sourced from PubChem (CID 122714220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).