2-ethyl-2-(methylamino)butanoic acid;uranium(2+)

C7H13NO2U — CID 176948121

IUPAC2-ethyl-2-(methylamino)butanoic acid;uranium(2+)
SMILES[CH2-]CC(C[CH2-])(NC)C(=O)O.[U+2]
InChIInChI=1S/C7H13NO2.U/c1-4-7(5-2,8-3)6(9)10;/h8H,1-2,4-5H2,3H3,(H,9,10);/q-2;+2
InChIKeyJYGXFDYGPSLKJC-UHFFFAOYSA-N
MW381.22 g/mol
LogP0.48
Rot. Bonds4

About 2-ethyl-2-(methylamino)butanoic acid;uranium(2+)

2-ethyl-2-(methylamino)butanoic acid;uranium(2+) (PubChem CID 176948121) has the molecular formula C7H13NO2U and a molecular weight of 381.22 g/mol. Its IUPAC name is 2-ethyl-2-(methylamino)butanoic acid;uranium(2+).

Molecular Properties

Compound Name2-ethyl-2-(methylamino)butanoic acid;uranium(2+)
PubChem CID176948121
Molecular FormulaC7H13NO2U
Molecular Weight381.22 g/mol
Exact Mass381.15
IUPAC Name2-ethyl-2-(methylamino)butanoic acid;uranium(2+)
SMILES[CH2-]CC(C[CH2-])(NC)C(=O)O.[U+2]
InChIInChI=1S/C7H13NO2.U/c1-4-7(5-2,8-3)6(9)10;/h8H,1-2,4-5H2,3H3,(H,9,10);/q-2;+2
InChIKeyJYGXFDYGPSLKJC-UHFFFAOYSA-N
XLogP0.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.22
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

4-methyl-2-(methylamino)-2-(2-methylpropyl)pentanoic acid
CID 114868050
2-ethyl-4-methyl-2-(methylamino)hexanoic acid
CID 43753669
5-ethoxy-2-ethyl-2-(methylamino)pentanoic acid
CID 106806917
2-ethyl-5-[3-(2-methoxyethoxy)propoxy]-2-(methylamino)pentanoic acid
CID 106807199
2-(1,2,3-tricarboxypropan-2-ylamino)propane-1,2,3-tricarboxylic acid
CID 66559167
2-[[(2S)-2-amino-4-methylpentanoyl]amino]-2-ethylbutanoic acid
CID 79803549
2-ethyl-2-(methylamino)-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pentanoic acid
CID 106807155
5-(2,2-difluoroethoxy)-2-ethyl-2-(methylamino)pentanoic acid
CID 106807139
2-ethyl-5-(1-hydroxypropan-2-ylsulfanyl)-2-(methylamino)pentanoic acid
CID 106807651
2-ethyl-2-formamidobutanoic acid
CID 63689307
2-ethyl-5-[ethyl(2,2,2-trifluoroethyl)amino]-2-(methylamino)pentanoic acid
CID 106805906
2-ethyl-2-(methylamino)-5-pyrazol-1-ylpentanoic acid
CID 106806593

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(methylamino)butanoic acid;uranium(2+)?
The IUPAC name of 2-ethyl-2-(methylamino)butanoic acid;uranium(2+) (CID 176948121) is 2-ethyl-2-(methylamino)butanoic acid;uranium(2+).
What is the SMILES notation for 2-ethyl-2-(methylamino)butanoic acid;uranium(2+)?
The canonical SMILES for 2-ethyl-2-(methylamino)butanoic acid;uranium(2+) is [CH2-]CC(C[CH2-])(NC)C(=O)O.[U+2].
What is the InChIKey of 2-ethyl-2-(methylamino)butanoic acid;uranium(2+)?
The InChIKey is JYGXFDYGPSLKJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2.U/c1-4-7(5-2,8-3)6(9)10;/h8H,1-2,4-5H2,3H3,(H,9,10);/q-2;+2.
What are the key properties of 2-ethyl-2-(methylamino)butanoic acid;uranium(2+)?
2-ethyl-2-(methylamino)butanoic acid;uranium(2+) has a molecular weight of 381.22 g/mol, XLogP of 0.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(methylamino)butanoic acid;uranium(2+) is sourced from PubChem (CID 176948121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).