lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride

C6H14LiNO2 — CID 173147542

IUPAClithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride
SMILESCC[C@H](C)[C@H](N)C(=O)O.[H-].[Li+]
InChIInChI=1S/C6H13NO2.Li.H/c1-3-4(2)5(7)6(8)9;;/h4-5H,3,7H2,1-2H3,(H,8,9);;/q;+1;-1/t4-,5-;;/m0../s1
InChIKeyJMOADUNJSGKSKE-RSLHMRQOSA-N
MW139.12 g/mol
LogP-2.44
Rot. Bonds3

About lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride

lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride (PubChem CID 173147542) has the molecular formula C6H14LiNO2 and a molecular weight of 139.12 g/mol. Its IUPAC name is lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride.

Molecular Properties

Compound Namelithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride
PubChem CID173147542
Molecular FormulaC6H14LiNO2
Molecular Weight139.12 g/mol
Exact Mass139.12
IUPAC Namelithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride
SMILESCC[C@H](C)[C@H](N)C(=O)O.[H-].[Li+]
InChIInChI=1S/C6H13NO2.Li.H/c1-3-4(2)5(7)6(8)9;;/h4-5H,3,7H2,1-2H3,(H,8,9);;/q;+1;-1/t4-,5-;;/m0../s1
InChIKeyJMOADUNJSGKSKE-RSLHMRQOSA-N
XLogP-2.44
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.12
LogP ≤ 5-2.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3S)-2-amino-3-(113C)methylpentanoic acid
CID 10606774
(2S,3S)-2-(15N)azanyl-3-methylpentanoic acid
CID 10678279
(2S,3R)-2-amino-3-methylpentanoic acid;hydrate
CID 162355380
2-amino-3-methylpentanoic acid;azane
CID 87185080
2-amino-3-methylpentanoic acid;manganese
CID 175109832
sodium (2S,3S)-2-amino-3-methylpentanoic acid
CID 71594993
2-amino-3-methylpentanoic acid;hydrochloride
CID 13000955
2-amino-3-methylpentanoic acid;sulfuric acid
CID 87083473
bis((2S,3S)-2-amino-3-methylpentanoic acid);formaldehyde
CID 174851375
2-amino-3-hydroxybutanoic acid;2-amino-3-methylpentanoic acid
CID 22316344
2-aminoacetic acid;(2R)-2-amino-3-methylpentanoic acid
CID 87257190
2-aminoacetic acid;2-amino-3-methylpentanoic acid;2-aminopropanoic acid
CID 18783681

Frequently Asked Questions

What is the IUPAC name of lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride?
The IUPAC name of lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride (CID 173147542) is lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride.
What is the SMILES notation for lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride?
The canonical SMILES for lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride is CC[C@H](C)[C@H](N)C(=O)O.[H-].[Li+].
What is the InChIKey of lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride?
The InChIKey is JMOADUNJSGKSKE-RSLHMRQOSA-N. The full InChI is InChI=1S/C6H13NO2.Li.H/c1-3-4(2)5(7)6(8)9;;/h4-5H,3,7H2,1-2H3,(H,8,9);;/q;+1;-1/t4-,5-;;/m0../s1.
What are the key properties of lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride?
lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride has a molecular weight of 139.12 g/mol, XLogP of -2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;(2S,3S)-2-amino-3-methylpentanoic acid;hydride is sourced from PubChem (CID 173147542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).