2-amino-3-fluoro-2-methylpropanoic acid

C4H8FNO2 — CID 10898956

IUPAC2-amino-3-fluoro-2-methylpropanoic acid
SMILESCC(N)(CF)C(=O)O
InChIInChI=1S/C4H8FNO2/c1-4(6,2-5)3(7)8/h2,6H2,1H3,(H,7,8)
InChIKeySLEAPJHLNGFZHW-UHFFFAOYSA-N
MW121.11 g/mol
LogP-0.24
Rot. Bonds2

About 2-amino-3-fluoro-2-methylpropanoic acid

2-amino-3-fluoro-2-methylpropanoic acid (PubChem CID 10898956) has the molecular formula C4H8FNO2 and a molecular weight of 121.11 g/mol. Its IUPAC name is 2-amino-3-fluoro-2-methylpropanoic acid.

Molecular Properties

Compound Name2-amino-3-fluoro-2-methylpropanoic acid
PubChem CID10898956
Molecular FormulaC4H8FNO2
Molecular Weight121.11 g/mol
Exact Mass121.05
IUPAC Name2-amino-3-fluoro-2-methylpropanoic acid
SMILESCC(N)(CF)C(=O)O
InChIInChI=1S/C4H8FNO2/c1-4(6,2-5)3(7)8/h2,6H2,1H3,(H,7,8)
InChIKeySLEAPJHLNGFZHW-UHFFFAOYSA-N
XLogP-0.24
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.11
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-3-fluoro-2-methylpropanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-2-methylbutanoic acid
CID 6971276
2,7-diamino-2,7-dimethyloctanedioic acid
CID 18936054
2-amino-2-methyl-4-oxopentanoic acid
CID 22140646
2-amino-4-hydroxy-2-methylhexanoic acid
CID 87771326
(2R)-2-amino-3-[[(2R)-2-amino-2-carboxypropyl]disulfanyl]-2-methylpropanoic acid;dihydrochloride
CID 175936776
(2S)-2-amino-5,5-difluoro-2-methylheptanoic acid
CID 87211555
(2S)-2-amino-3-cyano-2-methylpropanoic acid
CID 45086571
(2S)-2-amino-2-methylbutanoic acid;sulfuric acid
CID 175752113
2-amino-6-hydroxy-2-methylhexanoic acid
CID 22000473
2,6-diamino-2-methylhexanoic acid
CID 3017540
2-amino-2,4-dimethylpentanedioic acid
CID 87224787
2-amino-4-methoxy-2-methylbutanoic acid
CID 18323200

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-fluoro-2-methylpropanoic acid?
The IUPAC name of 2-amino-3-fluoro-2-methylpropanoic acid (CID 10898956) is 2-amino-3-fluoro-2-methylpropanoic acid.
What is the SMILES notation for 2-amino-3-fluoro-2-methylpropanoic acid?
The canonical SMILES for 2-amino-3-fluoro-2-methylpropanoic acid is CC(N)(CF)C(=O)O.
What is the InChIKey of 2-amino-3-fluoro-2-methylpropanoic acid?
The InChIKey is SLEAPJHLNGFZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO2/c1-4(6,2-5)3(7)8/h2,6H2,1H3,(H,7,8).
What are the key properties of 2-amino-3-fluoro-2-methylpropanoic acid?
2-amino-3-fluoro-2-methylpropanoic acid has a molecular weight of 121.11 g/mol, XLogP of -0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-fluoro-2-methylpropanoic acid is sourced from PubChem (CID 10898956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).