2-amino-2-methanidylpropan-1-ol;gold(1+)

C4H10AuNO — CID 88844237

IUPAC2-amino-2-methanidylpropan-1-ol;gold(1+)
SMILES[Au+].[CH2-]C(C)(N)CO
InChIInChI=1S/C4H10NO.Au/c1-4(2,5)3-6;/h6H,1,3,5H2,2H3;/q-1;+1
InChIKeyPLTHHYKBFYQMSH-UHFFFAOYSA-N
MW285.10 g/mol
LogP-0.47
Rot. Bonds1

About 2-amino-2-methanidylpropan-1-ol;gold(1+)

2-amino-2-methanidylpropan-1-ol;gold(1+) (PubChem CID 88844237) has the molecular formula C4H10AuNO and a molecular weight of 285.10 g/mol. Its IUPAC name is 2-amino-2-methanidylpropan-1-ol;gold(1+).

Molecular Properties

Compound Name2-amino-2-methanidylpropan-1-ol;gold(1+)
PubChem CID88844237
Molecular FormulaC4H10AuNO
Molecular Weight285.10 g/mol
Exact Mass285.04
IUPAC Name2-amino-2-methanidylpropan-1-ol;gold(1+)
SMILES[Au+].[CH2-]C(C)(N)CO
InChIInChI=1S/C4H10NO.Au/c1-4(2,5)3-6;/h6H,1,3,5H2,2H3;/q-1;+1
InChIKeyPLTHHYKBFYQMSH-UHFFFAOYSA-N
XLogP-0.47
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.10
LogP ≤ 5-0.47
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

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CID 172847501
2-amino-2-methylpropane-1,3-diol;hydrate
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(2S)-2-amino-2,3,3-trimethylbutan-1-ol
CID 45072298
2,2-bis(2-aminopropan-2-yl)propane-1,3-diol
CID 88802194
5-amino-5-methylhexan-1-ol;hydrochloride
CID 172915971
2-amino-2-methylpropan-1-ol;carbonic acid
CID 21330274
2-amino-2-(dimethylamino)propan-1-ol
CID 169080218
2-amino-2-methylpropane-1,3-diol;propan-2-ol
CID 18519501
(2S)-2-amino-3,3,3-trifluoro-2-methylpropan-1-ol
CID 96565633
2-amino-1,1-dideuterio-2-methylpropan-1-ol
CID 140648531
alumane;2,2-dimethylpropan-1-ol
CID 174479314
2-(hydroxymethyl)-2-methylpropane-1,3-diol
CID 118432348

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methanidylpropan-1-ol;gold(1+)?
The IUPAC name of 2-amino-2-methanidylpropan-1-ol;gold(1+) (CID 88844237) is 2-amino-2-methanidylpropan-1-ol;gold(1+).
What is the SMILES notation for 2-amino-2-methanidylpropan-1-ol;gold(1+)?
The canonical SMILES for 2-amino-2-methanidylpropan-1-ol;gold(1+) is [Au+].[CH2-]C(C)(N)CO.
What is the InChIKey of 2-amino-2-methanidylpropan-1-ol;gold(1+)?
The InChIKey is PLTHHYKBFYQMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10NO.Au/c1-4(2,5)3-6;/h6H,1,3,5H2,2H3;/q-1;+1.
What are the key properties of 2-amino-2-methanidylpropan-1-ol;gold(1+)?
2-amino-2-methanidylpropan-1-ol;gold(1+) has a molecular weight of 285.10 g/mol, XLogP of -0.47, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methanidylpropan-1-ol;gold(1+) is sourced from PubChem (CID 88844237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).