2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide

C8H12F3NO2 — CID 62360896

IUPAC2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide
SMILESO=C(NC1CCCCC1O)C(F)(F)F
InChIInChI=1S/C8H12F3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(5)13/h5-6,13H,1-4H2,(H,12,14)
InChIKeyUEAIDZOHHRNGHS-UHFFFAOYSA-N
MW211.18 g/mol
LogP0.97
Rot. Bonds1

About 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide

2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide (PubChem CID 62360896) has the molecular formula C8H12F3NO2 and a molecular weight of 211.18 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide
PubChem CID62360896
Molecular FormulaC8H12F3NO2
Molecular Weight211.18 g/mol
Exact Mass211.08
IUPAC Name2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide
SMILESO=C(NC1CCCCC1O)C(F)(F)F
InChIInChI=1S/C8H12F3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(5)13/h5-6,13H,1-4H2,(H,12,14)
InChIKeyUEAIDZOHHRNGHS-UHFFFAOYSA-N
XLogP0.97
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.18
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-2,2-difluoro-N-[(1R,2S)-2-hydroxycyclohexyl]acetamide
CID 40538955
2,2,3,3,4,4,4-heptafluoro-N-[(1S,2R)-2-hydroxycyclohexyl]butanamide
CID 40538968
methyl N-[(1S,2R)-2-[(2,2,2-trifluoroacetyl)amino]cyclohexyl]carbamate
CID 118104467
3,3,3-trifluoro-N-[(1S,2S)-2-hydroxycyclohexyl]-2-(trifluoromethyl)propanamide
CID 103310253
2-(ethylamino)-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpropanamide
CID 94878499
trans-(1R,2R)-2-[(2,2,2-trifluoroacetyl)amino]cyclopentane-1-carboxylic acid
CID 84689581
3-amino-N-(2-hydroxycyclohexyl)-2,2,3-trimethylbutanamide
CID 65267153
3-amino-N-[(1S,2S)-2-hydroxycyclohexyl]-2,2-dimethylpropanamide
CID 94415384
1-[(1S,2S)-2-hydroxycyclohexyl]-3-(2,2,2-trifluoroethyl)urea
CID 104954569
3-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]-2,2-dimethylpropanamide
CID 107216789
2-bromo-N-(2-hydroxycyclohexyl)acetamide
CID 63680498
tert-butyl N-[2-[(2,2,2-trifluoroacetyl)amino]cyclohexyl]carbamate
CID 87320947

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide (CID 62360896) is 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide is O=C(NC1CCCCC1O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide?
The InChIKey is UEAIDZOHHRNGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(5)13/h5-6,13H,1-4H2,(H,12,14).
What are the key properties of 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide?
2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide has a molecular weight of 211.18 g/mol, XLogP of 0.97, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 62360896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).