2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide

C8H13F2NO2 — CID 130659500

IUPAC2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide
SMILESNC(=O)C(F)(F)C1(O)CCCCC1
InChIInChI=1S/C8H13F2NO2/c9-8(10,6(11)12)7(13)4-2-1-3-5-7/h13H,1-5H2,(H2,11,12)
InChIKeyNVFRUKMOTUJTJT-UHFFFAOYSA-N
MW193.19 g/mol
LogP0.80
Rot. Bonds2

About 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide

2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide (PubChem CID 130659500) has the molecular formula C8H13F2NO2 and a molecular weight of 193.19 g/mol. Its IUPAC name is 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide
PubChem CID130659500
Molecular FormulaC8H13F2NO2
Molecular Weight193.19 g/mol
Exact Mass193.09
IUPAC Name2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide
SMILESNC(=O)C(F)(F)C1(O)CCCCC1
InChIInChI=1S/C8H13F2NO2/c9-8(10,6(11)12)7(13)4-2-1-3-5-7/h13H,1-5H2,(H2,11,12)
InChIKeyNVFRUKMOTUJTJT-UHFFFAOYSA-N
XLogP0.80
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.19
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide 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-2-(1-hydroxycyclohexyl)acetamide?
The IUPAC name of 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide (CID 130659500) is 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide.
What is the SMILES notation for 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide?
The canonical SMILES for 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide is NC(=O)C(F)(F)C1(O)CCCCC1.
What is the InChIKey of 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide?
The InChIKey is NVFRUKMOTUJTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2NO2/c9-8(10,6(11)12)7(13)4-2-1-3-5-7/h13H,1-5H2,(H2,11,12).
What are the key properties of 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide?
2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide has a molecular weight of 193.19 g/mol, XLogP of 0.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-2-(1-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 130659500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).