lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride

C4H12LiNO3 — CID 173034607

IUPAClithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride
SMILESNC(CO)(CO)CO.[H-].[Li+]
InChIInChI=1S/C4H11NO3.Li.H/c5-4(1-6,2-7)3-8;;/h6-8H,1-3,5H2;;/q;+1;-1
InChIKeyIJUVEUGQHFTAQQ-UHFFFAOYSA-N
MW129.09 g/mol
LogP-5.22
Rot. Bonds3

About lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride

lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride (PubChem CID 173034607) has the molecular formula C4H12LiNO3 and a molecular weight of 129.09 g/mol. Its IUPAC name is lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride.

Molecular Properties

Compound Namelithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride
PubChem CID173034607
Molecular FormulaC4H12LiNO3
Molecular Weight129.09 g/mol
Exact Mass129.10
IUPAC Namelithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride
SMILESNC(CO)(CO)CO.[H-].[Li+]
InChIInChI=1S/C4H11NO3.Li.H/c5-4(1-6,2-7)3-8;;/h6-8H,1-3,5H2;;/q;+1;-1
InChIKeyIJUVEUGQHFTAQQ-UHFFFAOYSA-N
XLogP-5.22
TPSA86.71 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.09
LogP ≤ 5-5.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride?
The IUPAC name of lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride (CID 173034607) is lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride.
What is the SMILES notation for lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride?
The canonical SMILES for lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride is NC(CO)(CO)CO.[H-].[Li+].
What is the InChIKey of lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride?
The InChIKey is IJUVEUGQHFTAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO3.Li.H/c5-4(1-6,2-7)3-8;;/h6-8H,1-3,5H2;;/q;+1;-1.
What are the key properties of lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride?
lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride has a molecular weight of 129.09 g/mol, XLogP of -5.22, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride is sourced from PubChem (CID 173034607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).