(2S,3R)-2,3-difluorohexanamide

C6H11F2NO — CID 155931762

IUPAC(2S,3R)-2,3-difluorohexanamide
SMILESCCC[C@@H](F)[C@@H](F)C(N)=O
InChIInChI=1S/C6H11F2NO/c1-2-3-4(7)5(8)6(9)10/h4-5H,2-3H2,1H3,(H2,9,10)/t4-,5-/m1/s1
InChIKeyHMUUDUSWGGNEMF-RFZPGFLSSA-N
MW151.16 g/mol
LogP0.95
Rot. Bonds4

About (2S,3R)-2,3-difluorohexanamide

(2S,3R)-2,3-difluorohexanamide (PubChem CID 155931762) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is (2S,3R)-2,3-difluorohexanamide.

Molecular Properties

Compound Name(2S,3R)-2,3-difluorohexanamide
PubChem CID155931762
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name(2S,3R)-2,3-difluorohexanamide
SMILESCCC[C@@H](F)[C@@H](F)C(N)=O
InChIInChI=1S/C6H11F2NO/c1-2-3-4(7)5(8)6(9)10/h4-5H,2-3H2,1H3,(H2,9,10)/t4-,5-/m1/s1
InChIKeyHMUUDUSWGGNEMF-RFZPGFLSSA-N
XLogP0.95
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2S,3R)-2,3-difluorohexanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-2,3-difluorohexanamide?
The IUPAC name of (2S,3R)-2,3-difluorohexanamide (CID 155931762) is (2S,3R)-2,3-difluorohexanamide.
What is the SMILES notation for (2S,3R)-2,3-difluorohexanamide?
The canonical SMILES for (2S,3R)-2,3-difluorohexanamide is CCC[C@@H](F)[C@@H](F)C(N)=O.
What is the InChIKey of (2S,3R)-2,3-difluorohexanamide?
The InChIKey is HMUUDUSWGGNEMF-RFZPGFLSSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-2-3-4(7)5(8)6(9)10/h4-5H,2-3H2,1H3,(H2,9,10)/t4-,5-/m1/s1.
What are the key properties of (2S,3R)-2,3-difluorohexanamide?
(2S,3R)-2,3-difluorohexanamide has a molecular weight of 151.16 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-2,3-difluorohexanamide is sourced from PubChem (CID 155931762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).