(2S)-2-fluoro-4-hydroxy-2-methylbutanamide

C5H10FNO2 — CID 173464744

IUPAC(2S)-2-fluoro-4-hydroxy-2-methylbutanamide
SMILESC[C@](F)(CCO)C(N)=O
InChIInChI=1S/C5H10FNO2/c1-5(6,2-3-8)4(7)9/h8H,2-3H2,1H3,(H2,7,9)/t5-/m0/s1
InChIKeyGWILSAVRKLQEQN-YFKPBYRVSA-N
MW135.14 g/mol
LogP-0.42
Rot. Bonds3

About (2S)-2-fluoro-4-hydroxy-2-methylbutanamide

(2S)-2-fluoro-4-hydroxy-2-methylbutanamide (PubChem CID 173464744) has the molecular formula C5H10FNO2 and a molecular weight of 135.14 g/mol. Its IUPAC name is (2S)-2-fluoro-4-hydroxy-2-methylbutanamide.

Molecular Properties

Compound Name(2S)-2-fluoro-4-hydroxy-2-methylbutanamide
PubChem CID173464744
Molecular FormulaC5H10FNO2
Molecular Weight135.14 g/mol
Exact Mass135.07
IUPAC Name(2S)-2-fluoro-4-hydroxy-2-methylbutanamide
SMILESC[C@](F)(CCO)C(N)=O
InChIInChI=1S/C5H10FNO2/c1-5(6,2-3-8)4(7)9/h8H,2-3H2,1H3,(H2,7,9)/t5-/m0/s1
InChIKeyGWILSAVRKLQEQN-YFKPBYRVSA-N
XLogP-0.42
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-fluoro-4-hydroxy-2-methylbutanamide?
The IUPAC name of (2S)-2-fluoro-4-hydroxy-2-methylbutanamide (CID 173464744) is (2S)-2-fluoro-4-hydroxy-2-methylbutanamide.
What is the SMILES notation for (2S)-2-fluoro-4-hydroxy-2-methylbutanamide?
The canonical SMILES for (2S)-2-fluoro-4-hydroxy-2-methylbutanamide is C[C@](F)(CCO)C(N)=O.
What is the InChIKey of (2S)-2-fluoro-4-hydroxy-2-methylbutanamide?
The InChIKey is GWILSAVRKLQEQN-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H10FNO2/c1-5(6,2-3-8)4(7)9/h8H,2-3H2,1H3,(H2,7,9)/t5-/m0/s1.
What are the key properties of (2S)-2-fluoro-4-hydroxy-2-methylbutanamide?
(2S)-2-fluoro-4-hydroxy-2-methylbutanamide has a molecular weight of 135.14 g/mol, XLogP of -0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-fluoro-4-hydroxy-2-methylbutanamide is sourced from PubChem (CID 173464744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).