3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine

C10H23NOSi — CID 67254072

IUPAC3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine
SMILESCC1(CCCN)CCC[Si](C)(C)O1
InChIInChI=1S/C10H23NOSi/c1-10(6-4-8-11)7-5-9-13(2,3)12-10/h4-9,11H2,1-3H3
InChIKeyCEIQKVZJSMRXFL-UHFFFAOYSA-N
MW201.39 g/mol
LogP2.50
Rot. Bonds3

About 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine

3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine (PubChem CID 67254072) has the molecular formula C10H23NOSi and a molecular weight of 201.39 g/mol. Its IUPAC name is 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine
PubChem CID67254072
Molecular FormulaC10H23NOSi
Molecular Weight201.39 g/mol
Exact Mass201.15
IUPAC Name3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine
SMILESCC1(CCCN)CCC[Si](C)(C)O1
InChIInChI=1S/C10H23NOSi/c1-10(6-4-8-11)7-5-9-13(2,3)12-10/h4-9,11H2,1-3H3
InChIKeyCEIQKVZJSMRXFL-UHFFFAOYSA-N
XLogP2.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine?
The IUPAC name of 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine (CID 67254072) is 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine.
What is the SMILES notation for 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine?
The canonical SMILES for 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine is CC1(CCCN)CCC[Si](C)(C)O1.
What is the InChIKey of 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine?
The InChIKey is CEIQKVZJSMRXFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NOSi/c1-10(6-4-8-11)7-5-9-13(2,3)12-10/h4-9,11H2,1-3H3.
What are the key properties of 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine?
3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine has a molecular weight of 201.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,6-trimethyloxasilinan-6-yl)propan-1-amine is sourced from PubChem (CID 67254072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).