4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium

C8H15NO3Y — CID 20706812

IUPAC4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium
SMILESCC(C(=O)O)C(C)C(=O)N(C)C.[Y]
InChIInChI=1S/C8H15NO3.Y/c1-5(6(2)8(11)12)7(10)9(3)4;/h5-6H,1-4H3,(H,11,12);
InChIKeyNCNRVZBADGCEGV-UHFFFAOYSA-N
MW262.12 g/mol
LogP0.43
Rot. Bonds3

About 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium

4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium (PubChem CID 20706812) has the molecular formula C8H15NO3Y and a molecular weight of 262.12 g/mol. Its IUPAC name is 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium.

Molecular Properties

Compound Name4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium
PubChem CID20706812
Molecular FormulaC8H15NO3Y
Molecular Weight262.12 g/mol
Exact Mass262.01
IUPAC Name4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium
SMILESCC(C(=O)O)C(C)C(=O)N(C)C.[Y]
InChIInChI=1S/C8H15NO3.Y/c1-5(6(2)8(11)12)7(10)9(3)4;/h5-6H,1-4H3,(H,11,12);
InChIKeyNCNRVZBADGCEGV-UHFFFAOYSA-N
XLogP0.43
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.12
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;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 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium?
The IUPAC name of 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium (CID 20706812) is 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium.
What is the SMILES notation for 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium?
The canonical SMILES for 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium is CC(C(=O)O)C(C)C(=O)N(C)C.[Y].
What is the InChIKey of 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium?
The InChIKey is NCNRVZBADGCEGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3.Y/c1-5(6(2)8(11)12)7(10)9(3)4;/h5-6H,1-4H3,(H,11,12);.
What are the key properties of 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium?
4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium has a molecular weight of 262.12 g/mol, XLogP of 0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-2,3-dimethyl-4-oxobutanoic acid;yttrium is sourced from PubChem (CID 20706812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).