azane;oxasilinane

C4H13NOSi — CID 173001545

IUPACazane;oxasilinane
SMILESC1CC[SiH2]OC1.N
InChIInChI=1S/C4H10OSi.H3N/c1-2-4-6-5-3-1;/h1-4,6H2;1H3
InChIKeyMQXUVTKEMGWBFG-UHFFFAOYSA-N
MW119.24 g/mol
LogP0.46
Rot. Bonds

About azane;oxasilinane

azane;oxasilinane (PubChem CID 173001545) has the molecular formula C4H13NOSi and a molecular weight of 119.24 g/mol. Its IUPAC name is azane;oxasilinane.

Molecular Properties

Compound Nameazane;oxasilinane
PubChem CID173001545
Molecular FormulaC4H13NOSi
Molecular Weight119.24 g/mol
Exact Mass119.08
IUPAC Nameazane;oxasilinane
SMILESC1CC[SiH2]OC1.N
InChIInChI=1S/C4H10OSi.H3N/c1-2-4-6-5-3-1;/h1-4,6H2;1H3
InChIKeyMQXUVTKEMGWBFG-UHFFFAOYSA-N
XLogP0.46
TPSA44.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.24
LogP ≤ 50.46
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 azane;oxasilinane?
The IUPAC name of azane;oxasilinane (CID 173001545) is azane;oxasilinane.
What is the SMILES notation for azane;oxasilinane?
The canonical SMILES for azane;oxasilinane is C1CC[SiH2]OC1.N.
What is the InChIKey of azane;oxasilinane?
The InChIKey is MQXUVTKEMGWBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10OSi.H3N/c1-2-4-6-5-3-1;/h1-4,6H2;1H3.
What are the key properties of azane;oxasilinane?
azane;oxasilinane has a molecular weight of 119.24 g/mol, XLogP of 0.46, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;oxasilinane is sourced from PubChem (CID 173001545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).