2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide

C8H8F2N2O2 — CID 45039015

IUPAC2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide
SMILESNC(=O)C(F)(F)C(O)c1cccnc1
InChIInChI=1S/C8H8F2N2O2/c9-8(10,7(11)14)6(13)5-2-1-3-12-4-5/h1-4,6,13H,(H2,11,14)
InChIKeyGNDJRERNXNTLQZ-UHFFFAOYSA-N
MW202.16 g/mol
LogP0.24
Rot. Bonds3

About 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide

2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide (PubChem CID 45039015) has the molecular formula C8H8F2N2O2 and a molecular weight of 202.16 g/mol. Its IUPAC name is 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide
PubChem CID45039015
Molecular FormulaC8H8F2N2O2
Molecular Weight202.16 g/mol
Exact Mass202.06
IUPAC Name2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide
SMILESNC(=O)C(F)(F)C(O)c1cccnc1
InChIInChI=1S/C8H8F2N2O2/c9-8(10,7(11)14)6(13)5-2-1-3-12-4-5/h1-4,6,13H,(H2,11,14)
InChIKeyGNDJRERNXNTLQZ-UHFFFAOYSA-N
XLogP0.24
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.16
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide 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 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide?
The IUPAC name of 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide (CID 45039015) is 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide.
What is the SMILES notation for 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide?
The canonical SMILES for 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide is NC(=O)C(F)(F)C(O)c1cccnc1.
What is the InChIKey of 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide?
The InChIKey is GNDJRERNXNTLQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O2/c9-8(10,7(11)14)6(13)5-2-1-3-12-4-5/h1-4,6,13H,(H2,11,14).
What are the key properties of 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide?
2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide has a molecular weight of 202.16 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-3-hydroxy-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 45039015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).