lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride

C8H18LiNO2 — CID 174387889

IUPAClithium;2-amino-2,3,3-trimethylpentanoic acid;hydride
SMILESCCC(C)(C)C(C)(N)C(=O)O.[H-].[Li+]
InChIInChI=1S/C8H17NO2.Li.H/c1-5-7(2,3)8(4,9)6(10)11;;/h5,9H2,1-4H3,(H,10,11);;/q;+1;-1
InChIKeyMCEGTJNGUGIVNO-UHFFFAOYSA-N
MW167.18 g/mol
LogP-1.66
Rot. Bonds3

About lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride

lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride (PubChem CID 174387889) has the molecular formula C8H18LiNO2 and a molecular weight of 167.18 g/mol. Its IUPAC name is lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride.

Molecular Properties

Compound Namelithium;2-amino-2,3,3-trimethylpentanoic acid;hydride
PubChem CID174387889
Molecular FormulaC8H18LiNO2
Molecular Weight167.18 g/mol
Exact Mass167.15
IUPAC Namelithium;2-amino-2,3,3-trimethylpentanoic acid;hydride
SMILESCCC(C)(C)C(C)(N)C(=O)O.[H-].[Li+]
InChIInChI=1S/C8H17NO2.Li.H/c1-5-7(2,3)8(4,9)6(10)11;;/h5,9H2,1-4H3,(H,10,11);;/q;+1;-1
InChIKeyMCEGTJNGUGIVNO-UHFFFAOYSA-N
XLogP-1.66
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 5-1.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-2-methylbutanoic acid
CID 6971276
azane;2,2-diethylbutanoic acid
CID 173369262
2-aminobutan-2-ol;azane;sulfuric acid
CID 174805988
(2S)-2-amino-2-methylbutanoic acid;sulfuric acid
CID 175752113
2-amino-2,3,3-trimethylbutanoic acid;dihydrochloride
CID 140576476
2-(2-ethyl-2-hydroxybutyl)sulfanyl-2-methylpropanoic acid
CID 114491469
2-bromo-2-(2-methylbutan-2-yl)propanedioic acid
CID 12673913
sodium;2-amino-2-(hydroxymethyl)butanoic acid;hydride
CID 174202899
4-amino-2,2,4-trimethylhexanoic acid
CID 89085708
2-amino-2-iodobutanoic acid
CID 19595827
2-amino-2-sulfanylbutanoic acid
CID 18369133
3-amino-2,3-dimethylbutan-2-ol;2-ethyl-2-propan-2-ylpropanedioic acid
CID 88689806

Frequently Asked Questions

What is the IUPAC name of lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride?
The IUPAC name of lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride (CID 174387889) is lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride.
What is the SMILES notation for lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride?
The canonical SMILES for lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride is CCC(C)(C)C(C)(N)C(=O)O.[H-].[Li+].
What is the InChIKey of lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride?
The InChIKey is MCEGTJNGUGIVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2.Li.H/c1-5-7(2,3)8(4,9)6(10)11;;/h5,9H2,1-4H3,(H,10,11);;/q;+1;-1.
What are the key properties of lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride?
lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride has a molecular weight of 167.18 g/mol, XLogP of -1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;2-amino-2,3,3-trimethylpentanoic acid;hydride is sourced from PubChem (CID 174387889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).