2-aminobutanedioic acid;dihydroxy(dimethyl)silane

C6H15NO6Si — CID 158066408

IUPAC2-aminobutanedioic acid;dihydroxy(dimethyl)silane
SMILESC[Si](C)(O)O.NC(CC(=O)O)C(=O)O
InChIInChI=1S/C4H7NO4.C2H8O2Si/c5-2(4(8)9)1-3(6)7;1-5(2,3)4/h2H,1,5H2,(H,6,7)(H,8,9);3-4H,1-2H3
InChIKeyFLGXLXBCBIXIDZ-UHFFFAOYSA-N
MW225.27 g/mol
LogP-1.45
Rot. Bonds3

About 2-aminobutanedioic acid;dihydroxy(dimethyl)silane

2-aminobutanedioic acid;dihydroxy(dimethyl)silane (PubChem CID 158066408) has the molecular formula C6H15NO6Si and a molecular weight of 225.27 g/mol. Its IUPAC name is 2-aminobutanedioic acid;dihydroxy(dimethyl)silane.

Molecular Properties

Compound Name2-aminobutanedioic acid;dihydroxy(dimethyl)silane
PubChem CID158066408
Molecular FormulaC6H15NO6Si
Molecular Weight225.27 g/mol
Exact Mass225.07
IUPAC Name2-aminobutanedioic acid;dihydroxy(dimethyl)silane
SMILESC[Si](C)(O)O.NC(CC(=O)O)C(=O)O
InChIInChI=1S/C4H7NO4.C2H8O2Si/c5-2(4(8)9)1-3(6)7;1-5(2,3)4/h2H,1,5H2,(H,6,7)(H,8,9);3-4H,1-2H3
InChIKeyFLGXLXBCBIXIDZ-UHFFFAOYSA-N
XLogP-1.45
TPSA141.08 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 5-1.45
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

tris(2-aminobutanedioic acid);iron(3+)
CID 10456673
2-aminobutanedioic acid;selane
CID 174828111
2-(15N)azanyl(113C)butanedioic acid;hydrochloride
CID 171689483
(2S)-2-aminobutanedioic acid;molybdenum
CID 174753178
2-aminobutanedioic acid;molybdenum
CID 76550864
tris((2S)-2-aminobutanedioic acid);phosphane
CID 172741864
azanium (2S)-2-aminobutanedioic acid
CID 10130050
CID 131864134
CID 131864134
2-aminobutanedioic acid;bis(2-aminopropanoic acid)
CID 154929079
2-aminobutanedioic acid;carbamic acid
CID 87364941
calcium;2-aminobutanedioic acid;hydron
CID 173271568
CID 173060561
CID 173060561

Frequently Asked Questions

What is the IUPAC name of 2-aminobutanedioic acid;dihydroxy(dimethyl)silane?
The IUPAC name of 2-aminobutanedioic acid;dihydroxy(dimethyl)silane (CID 158066408) is 2-aminobutanedioic acid;dihydroxy(dimethyl)silane.
What is the SMILES notation for 2-aminobutanedioic acid;dihydroxy(dimethyl)silane?
The canonical SMILES for 2-aminobutanedioic acid;dihydroxy(dimethyl)silane is C[Si](C)(O)O.NC(CC(=O)O)C(=O)O.
What is the InChIKey of 2-aminobutanedioic acid;dihydroxy(dimethyl)silane?
The InChIKey is FLGXLXBCBIXIDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO4.C2H8O2Si/c5-2(4(8)9)1-3(6)7;1-5(2,3)4/h2H,1,5H2,(H,6,7)(H,8,9);3-4H,1-2H3.
What are the key properties of 2-aminobutanedioic acid;dihydroxy(dimethyl)silane?
2-aminobutanedioic acid;dihydroxy(dimethyl)silane has a molecular weight of 225.27 g/mol, XLogP of -1.45, 3 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminobutanedioic acid;dihydroxy(dimethyl)silane is sourced from PubChem (CID 158066408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).