aluminum 2-aminoacetaldehyde

C2H5AlNO+3 — CID 18366339

IUPACaluminum 2-aminoacetaldehyde
SMILESNCC=O.[Al+3]
InChIInChI=1S/C2H5NO.Al/c3-1-2-4;/h2H,1,3H2;/q;+3
InChIKeyWNEGVPLNUBLOOZ-UHFFFAOYSA-N
MW86.05 g/mol
LogP-1.24
Rot. Bonds1

About aluminum 2-aminoacetaldehyde

aluminum 2-aminoacetaldehyde (PubChem CID 18366339) has the molecular formula C2H5AlNO+3 and a molecular weight of 86.05 g/mol. Its IUPAC name is aluminum 2-aminoacetaldehyde.

Molecular Properties

Compound Namealuminum 2-aminoacetaldehyde
PubChem CID18366339
Molecular FormulaC2H5AlNO+3
Molecular Weight86.05 g/mol
Exact Mass86.02
IUPAC Namealuminum 2-aminoacetaldehyde
SMILESNCC=O.[Al+3]
InChIInChI=1S/C2H5NO.Al/c3-1-2-4;/h2H,1,3H2;/q;+3
InChIKeyWNEGVPLNUBLOOZ-UHFFFAOYSA-N
XLogP-1.24
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.05
LogP ≤ 5-1.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-aminoacetaldehyde;methanediamine
CID 163797808
2-aminoacetaldehyde;molecular hydrogen;propane
CID 162518471
2-aminoacetaldehyde;deuteride;deuterioethane;ethane;methane
CID 159516674
2-aminoacetaldehyde;2,2,2-trifluoroacetic acid
CID 171923069
2-amino-1-tritioethanone
CID 123742496
2-aminoacetaldehyde;1-methoxypropane
CID 142289100
N-(aminomethyl)-N-formylformamide
CID 158356927
propanal;trihydrochloride
CID 140558923
propanal;propane
CID 91031727
ethane-1,2-diamine;formamide
CID 19935247
methane;propanal
CID 159115270
2-aminoacetaldehyde;carbonic acid;bis(2-methylpropane);1,4-xylene
CID 173007512

Frequently Asked Questions

What is the IUPAC name of aluminum 2-aminoacetaldehyde?
The IUPAC name of aluminum 2-aminoacetaldehyde (CID 18366339) is aluminum 2-aminoacetaldehyde.
What is the SMILES notation for aluminum 2-aminoacetaldehyde?
The canonical SMILES for aluminum 2-aminoacetaldehyde is NCC=O.[Al+3].
What is the InChIKey of aluminum 2-aminoacetaldehyde?
The InChIKey is WNEGVPLNUBLOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5NO.Al/c3-1-2-4;/h2H,1,3H2;/q;+3.
What are the key properties of aluminum 2-aminoacetaldehyde?
aluminum 2-aminoacetaldehyde has a molecular weight of 86.05 g/mol, XLogP of -1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum 2-aminoacetaldehyde is sourced from PubChem (CID 18366339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).