trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide

C16H37Li3N4OSi — CID 139134113

IUPACtrilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide
SMILESC1CCOC1.CC(C)[N-][Si]([N-]C(C)C)([N-]C(C)C)NC(C)C.[Li+].[Li+].[Li+]
InChIInChI=1S/C12H29N4Si.C4H8O.3Li/c1-9(2)13-17(14-10(3)4,15-11(5)6)16-12(7)8;1-2-4-5-3-1;;;/h9-13H,1-8H3;1-4H2;;;/q-3;;3*+1
InChIKeyAJKMHYZLLSYSQA-UHFFFAOYSA-N
MW350.41 g/mol
LogP-4.42
Rot. Bonds8

About trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide

trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide (PubChem CID 139134113) has the molecular formula C16H37Li3N4OSi and a molecular weight of 350.41 g/mol. Its IUPAC name is trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide.

Molecular Properties

Compound Nametrilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide
PubChem CID139134113
Molecular FormulaC16H37Li3N4OSi
Molecular Weight350.41 g/mol
Exact Mass350.32
IUPAC Nametrilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide
SMILESC1CCOC1.CC(C)[N-][Si]([N-]C(C)C)([N-]C(C)C)NC(C)C.[Li+].[Li+].[Li+]
InChIInChI=1S/C12H29N4Si.C4H8O.3Li/c1-9(2)13-17(14-10(3)4,15-11(5)6)16-12(7)8;1-2-4-5-3-1;;;/h9-13H,1-8H3;1-4H2;;;/q-3;;3*+1
InChIKeyAJKMHYZLLSYSQA-UHFFFAOYSA-N
XLogP-4.42
TPSA63.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.41
LogP ≤ 5-4.42
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 trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide?
The IUPAC name of trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide (CID 139134113) is trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide.
What is the SMILES notation for trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide?
The canonical SMILES for trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide is C1CCOC1.CC(C)[N-][Si]([N-]C(C)C)([N-]C(C)C)NC(C)C.[Li+].[Li+].[Li+].
What is the InChIKey of trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide?
The InChIKey is AJKMHYZLLSYSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29N4Si.C4H8O.3Li/c1-9(2)13-17(14-10(3)4,15-11(5)6)16-12(7)8;1-2-4-5-3-1;;;/h9-13H,1-8H3;1-4H2;;;/q-3;;3*+1.
What are the key properties of trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide?
trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide has a molecular weight of 350.41 g/mol, XLogP of -4.42, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trilithium;oxolane;propan-2-yl-[(propan-2-ylamino)-bis(propan-2-ylazanidyl)silyl]azanide is sourced from PubChem (CID 139134113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).