1-(dimethylamino)-2-methylpropan-2-ol;nickel

C6H15NNiO — CID 158562647

IUPAC1-(dimethylamino)-2-methylpropan-2-ol;nickel
SMILESCN(C)CC(C)(C)O.[Ni]
InChIInChI=1S/C6H15NO.Ni/c1-6(2,8)5-7(3)4;/h8H,5H2,1-4H3;
InChIKeyHRBNWTUFSCFRKY-UHFFFAOYSA-N
MW175.88 g/mol
LogP0.32
Rot. Bonds2

About 1-(dimethylamino)-2-methylpropan-2-ol;nickel

1-(dimethylamino)-2-methylpropan-2-ol;nickel (PubChem CID 158562647) has the molecular formula C6H15NNiO and a molecular weight of 175.88 g/mol. Its IUPAC name is 1-(dimethylamino)-2-methylpropan-2-ol;nickel.

Molecular Properties

Compound Name1-(dimethylamino)-2-methylpropan-2-ol;nickel
PubChem CID158562647
Molecular FormulaC6H15NNiO
Molecular Weight175.88 g/mol
Exact Mass175.05
IUPAC Name1-(dimethylamino)-2-methylpropan-2-ol;nickel
SMILESCN(C)CC(C)(C)O.[Ni]
InChIInChI=1S/C6H15NO.Ni/c1-6(2,8)5-7(3)4;/h8H,5H2,1-4H3;
InChIKeyHRBNWTUFSCFRKY-UHFFFAOYSA-N
XLogP0.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.88
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-2-methylpropan-2-ol;nickel?
The IUPAC name of 1-(dimethylamino)-2-methylpropan-2-ol;nickel (CID 158562647) is 1-(dimethylamino)-2-methylpropan-2-ol;nickel.
What is the SMILES notation for 1-(dimethylamino)-2-methylpropan-2-ol;nickel?
The canonical SMILES for 1-(dimethylamino)-2-methylpropan-2-ol;nickel is CN(C)CC(C)(C)O.[Ni].
What is the InChIKey of 1-(dimethylamino)-2-methylpropan-2-ol;nickel?
The InChIKey is HRBNWTUFSCFRKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO.Ni/c1-6(2,8)5-7(3)4;/h8H,5H2,1-4H3;.
What are the key properties of 1-(dimethylamino)-2-methylpropan-2-ol;nickel?
1-(dimethylamino)-2-methylpropan-2-ol;nickel has a molecular weight of 175.88 g/mol, XLogP of 0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-2-methylpropan-2-ol;nickel is sourced from PubChem (CID 158562647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).