3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium

C14H32NO2Y- — CID 158354276

IUPAC3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium
SMILESCOC(C)C(C)(C)C.C[N-]C(C)(C)C(C)OC.[Y]
InChIInChI=1S/C7H16NO.C7H16O.Y/c1-6(9-5)7(2,3)8-4;1-6(8-5)7(2,3)4;/h6H,1-5H3;6H,1-5H3;/q-1;;
InChIKeyQVTJSKAGZJJKNY-UHFFFAOYSA-N
MW335.32 g/mol
LogP3.87
Rot. Bonds4

About 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium

3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium (PubChem CID 158354276) has the molecular formula C14H32NO2Y- and a molecular weight of 335.32 g/mol. Its IUPAC name is 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium.

Molecular Properties

Compound Name3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium
PubChem CID158354276
Molecular FormulaC14H32NO2Y-
Molecular Weight335.32 g/mol
Exact Mass335.15
IUPAC Name3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium
SMILESCOC(C)C(C)(C)C.C[N-]C(C)(C)C(C)OC.[Y]
InChIInChI=1S/C7H16NO.C7H16O.Y/c1-6(9-5)7(2,3)8-4;1-6(8-5)7(2,3)4;/h6H,1-5H3;6H,1-5H3;/q-1;;
InChIKeyQVTJSKAGZJJKNY-UHFFFAOYSA-N
XLogP3.87
TPSA32.56 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.32
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium?
The IUPAC name of 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium (CID 158354276) is 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium.
What is the SMILES notation for 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium?
The canonical SMILES for 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium is COC(C)C(C)(C)C.C[N-]C(C)(C)C(C)OC.[Y].
What is the InChIKey of 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium?
The InChIKey is QVTJSKAGZJJKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16NO.C7H16O.Y/c1-6(9-5)7(2,3)8-4;1-6(8-5)7(2,3)4;/h6H,1-5H3;6H,1-5H3;/q-1;;.
What are the key properties of 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium?
3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium has a molecular weight of 335.32 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2,2-dimethylbutane;(3-methoxy-2-methylbutan-2-yl)-methylazanide;yttrium is sourced from PubChem (CID 158354276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).