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

C6H15NOTi — CID 58881655

IUPAC1-(dimethylamino)-2-methylpropan-2-ol;titanium
SMILESCN(C)CC(C)(C)O.[Ti]
InChIInChI=1S/C6H15NO.Ti/c1-6(2,8)5-7(3)4;/h8H,5H2,1-4H3;
InChIKeyYSHYKLOAIXTYKT-UHFFFAOYSA-N
MW165.06 g/mol
LogP0.32
Rot. Bonds2

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

1-(dimethylamino)-2-methylpropan-2-ol;titanium (PubChem CID 58881655) has the molecular formula C6H15NOTi and a molecular weight of 165.06 g/mol. Its IUPAC name is 1-(dimethylamino)-2-methylpropan-2-ol;titanium.

Molecular Properties

Compound Name1-(dimethylamino)-2-methylpropan-2-ol;titanium
PubChem CID58881655
Molecular FormulaC6H15NOTi
Molecular Weight165.06 g/mol
Exact Mass165.06
IUPAC Name1-(dimethylamino)-2-methylpropan-2-ol;titanium
SMILESCN(C)CC(C)(C)O.[Ti]
InChIInChI=1S/C6H15NO.Ti/c1-6(2,8)5-7(3)4;/h8H,5H2,1-4H3;
InChIKeyYSHYKLOAIXTYKT-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 ≤ 500165.06
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;titanium?
The IUPAC name of 1-(dimethylamino)-2-methylpropan-2-ol;titanium (CID 58881655) is 1-(dimethylamino)-2-methylpropan-2-ol;titanium.
What is the SMILES notation for 1-(dimethylamino)-2-methylpropan-2-ol;titanium?
The canonical SMILES for 1-(dimethylamino)-2-methylpropan-2-ol;titanium is CN(C)CC(C)(C)O.[Ti].
What is the InChIKey of 1-(dimethylamino)-2-methylpropan-2-ol;titanium?
The InChIKey is YSHYKLOAIXTYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO.Ti/c1-6(2,8)5-7(3)4;/h8H,5H2,1-4H3;.
What are the key properties of 1-(dimethylamino)-2-methylpropan-2-ol;titanium?
1-(dimethylamino)-2-methylpropan-2-ol;titanium has a molecular weight of 165.06 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;titanium is sourced from PubChem (CID 58881655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).