N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide

C8H12F3NO — CID 115769035

IUPACN-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide
SMILESCC(NC(=O)C(F)(F)F)C1CCC1
InChIInChI=1S/C8H12F3NO/c1-5(6-3-2-4-6)12-7(13)8(9,10)11/h5-6H,2-4H2,1H3,(H,12,13)
InChIKeyBTSRMSZWMMIAEK-UHFFFAOYSA-N
MW195.18 g/mol
LogP1.85
Rot. Bonds2

About N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide

N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide (PubChem CID 115769035) has the molecular formula C8H12F3NO and a molecular weight of 195.18 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide
PubChem CID115769035
Molecular FormulaC8H12F3NO
Molecular Weight195.18 g/mol
Exact Mass195.09
IUPAC NameN-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide
SMILESCC(NC(=O)C(F)(F)F)C1CCC1
InChIInChI=1S/C8H12F3NO/c1-5(6-3-2-4-6)12-7(13)8(9,10)11/h5-6H,2-4H2,1H3,(H,12,13)
InChIKeyBTSRMSZWMMIAEK-UHFFFAOYSA-N
XLogP1.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-cyclobutylethyl)acetamide
CID 115769098
N-[(1R)-1-cyclopentylethyl]-2-methoxy-2-methylpropanamide
CID 103029233
2-(1-cyclobutylethylamino)-2-oxoacetic acid
CID 104768741
N-[1-(2,2-dimethylcyclopropyl)ethyl]-2,2,2-trifluoroacetamide
CID 130971950
N-[(1S)-1-cyclohexylethyl]-2-methoxy-2-methylpropanamide
CID 103029230
N-[(1S)-1-cyclopentylethyl]acetamide
CID 81388909
1-(1-cyclobutylethyl)-3-cyclopropylurea
CID 115766433
3-(1-cyclobutylethyl)-1,1-dimethylurea
CID 115766548
3-amino-N-[(1S)-1-cycloheptylethyl]-2,2-dimethylpropanamide
CID 115426905
2,2,3,3-tetrafluoro-N-[1-(oxan-4-yl)ethyl]propanamide
CID 103769518
N-(2-amino-1-cyclopentylethyl)-2,2,2-trifluoroacetamide
CID 106737372
N-[(1R)-1-cyclopentylethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 81389110

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide?
The IUPAC name of N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide (CID 115769035) is N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide?
The canonical SMILES for N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide is CC(NC(=O)C(F)(F)F)C1CCC1.
What is the InChIKey of N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide?
The InChIKey is BTSRMSZWMMIAEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO/c1-5(6-3-2-4-6)12-7(13)8(9,10)11/h5-6H,2-4H2,1H3,(H,12,13).
What are the key properties of N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide?
N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide has a molecular weight of 195.18 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-2,2,2-trifluoroacetamide is sourced from PubChem (CID 115769035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).