(2S)-2-amino-4-fluoropent-4-enoic acid

C5H8FNO2 — CID 11240496

IUPAC(2S)-2-amino-4-fluoropent-4-enoic acid
SMILESC=C(F)C[C@H](N)C(=O)O
InChIInChI=1S/C5H8FNO2/c1-3(6)2-4(7)5(8)9/h4H,1-2,7H2,(H,8,9)/t4-/m0/s1
InChIKeyDDUIINAQOUGLIM-BYPYZUCNSA-N
MW133.12 g/mol
LogP0.27
Rot. Bonds3

About (2S)-2-amino-4-fluoropent-4-enoic acid

(2S)-2-amino-4-fluoropent-4-enoic acid (PubChem CID 11240496) has the molecular formula C5H8FNO2 and a molecular weight of 133.12 g/mol. Its IUPAC name is (2S)-2-amino-4-fluoropent-4-enoic acid.

Molecular Properties

Compound Name(2S)-2-amino-4-fluoropent-4-enoic acid
PubChem CID11240496
Molecular FormulaC5H8FNO2
Molecular Weight133.12 g/mol
Exact Mass133.05
IUPAC Name(2S)-2-amino-4-fluoropent-4-enoic acid
SMILESC=C(F)C[C@H](N)C(=O)O
InChIInChI=1S/C5H8FNO2/c1-3(6)2-4(7)5(8)9/h4H,1-2,7H2,(H,8,9)/t4-/m0/s1
InChIKeyDDUIINAQOUGLIM-BYPYZUCNSA-N
XLogP0.27
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.12
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-4-methylidenepentanedioic acid;hydrochloride
CID 46845579
3-amino-5-fluorohex-5-enoic acid
CID 89120212
tris(2-aminobutanedioic acid);iron(3+)
CID 10456673
2-aminobutanedioic acid;selane
CID 174828111
2-(15N)azanyl(113C)butanedioic acid;hydrochloride
CID 171689483
(2S)-2-aminobutanedioic acid;molybdenum
CID 174753178
2-aminobutanedioic acid;molybdenum
CID 76550864
tris((2S)-2-aminobutanedioic acid);phosphane
CID 172741864
azanium (2S)-2-aminobutanedioic acid
CID 10130050
CID 131864134
CID 131864134
(2R)-2-aminobutanedioic acid;zinc;hydrate
CID 156758175
bis(2,4-diamino-4-oxobutanoic acid);palladium
CID 3531876

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-fluoropent-4-enoic acid?
The IUPAC name of (2S)-2-amino-4-fluoropent-4-enoic acid (CID 11240496) is (2S)-2-amino-4-fluoropent-4-enoic acid.
What is the SMILES notation for (2S)-2-amino-4-fluoropent-4-enoic acid?
The canonical SMILES for (2S)-2-amino-4-fluoropent-4-enoic acid is C=C(F)C[C@H](N)C(=O)O.
What is the InChIKey of (2S)-2-amino-4-fluoropent-4-enoic acid?
The InChIKey is DDUIINAQOUGLIM-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H8FNO2/c1-3(6)2-4(7)5(8)9/h4H,1-2,7H2,(H,8,9)/t4-/m0/s1.
What are the key properties of (2S)-2-amino-4-fluoropent-4-enoic acid?
(2S)-2-amino-4-fluoropent-4-enoic acid has a molecular weight of 133.12 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-4-fluoropent-4-enoic acid is sourced from PubChem (CID 11240496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).