N-(2-cyclobutylethyl)-2,2-difluoroacetamide

C8H13F2NO — CID 103516050

IUPACN-(2-cyclobutylethyl)-2,2-difluoroacetamide
SMILESO=C(NCCC1CCC1)C(F)F
InChIInChI=1S/C8H13F2NO/c9-7(10)8(12)11-5-4-6-2-1-3-6/h6-7H,1-5H2,(H,11,12)
InChIKeyLLNZYUKHWAWIOG-UHFFFAOYSA-N
MW177.19 g/mol
LogP1.56
Rot. Bonds4

About N-(2-cyclobutylethyl)-2,2-difluoroacetamide

N-(2-cyclobutylethyl)-2,2-difluoroacetamide (PubChem CID 103516050) has the molecular formula C8H13F2NO and a molecular weight of 177.19 g/mol. Its IUPAC name is N-(2-cyclobutylethyl)-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-(2-cyclobutylethyl)-2,2-difluoroacetamide
PubChem CID103516050
Molecular FormulaC8H13F2NO
Molecular Weight177.19 g/mol
Exact Mass177.10
IUPAC NameN-(2-cyclobutylethyl)-2,2-difluoroacetamide
SMILESO=C(NCCC1CCC1)C(F)F
InChIInChI=1S/C8H13F2NO/c9-7(10)8(12)11-5-4-6-2-1-3-6/h6-7H,1-5H2,(H,11,12)
InChIKeyLLNZYUKHWAWIOG-UHFFFAOYSA-N
XLogP1.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.19
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-amino-N-(2-cyclobutylethyl)propanamide
CID 103797223
N-(2-cyclopentylethyl)-2-methoxypropanamide
CID 115588216
(2S)-2-amino-N-(2-cyclobutylethyl)pentanamide
CID 107570634
3-(2-cyclobutylethyl)-1,1-dimethylurea
CID 115687259
1-(2-cyclobutylethyl)-3-propylurea
CID 115686559
2-amino-N-(2-cyclopentylethyl)-3-hydroxypropanamide
CID 115180115
2-chloro-N-(2-cyclobutylethyl)acetamide
CID 115879965
4-(2-cyclopropylethylamino)-2,3-dimethyl-4-oxobutanoic acid
CID 103498677
N-(2-cyclohexylethyl)-2-methyl-3-(methylamino)propanamide
CID 79195699
(2R)-2-amino-N-(2-cyclohexylethyl)-3-methylbutanamide
CID 79012516
(2S)-2-amino-N-(2-cyclohexylethyl)-3-hydroxypropanamide
CID 70364930
2-(2-cyclohexylethylcarbamoyl)-3-methylbutanoic acid
CID 115186283

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutylethyl)-2,2-difluoroacetamide?
The IUPAC name of N-(2-cyclobutylethyl)-2,2-difluoroacetamide (CID 103516050) is N-(2-cyclobutylethyl)-2,2-difluoroacetamide.
What is the SMILES notation for N-(2-cyclobutylethyl)-2,2-difluoroacetamide?
The canonical SMILES for N-(2-cyclobutylethyl)-2,2-difluoroacetamide is O=C(NCCC1CCC1)C(F)F.
What is the InChIKey of N-(2-cyclobutylethyl)-2,2-difluoroacetamide?
The InChIKey is LLNZYUKHWAWIOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2NO/c9-7(10)8(12)11-5-4-6-2-1-3-6/h6-7H,1-5H2,(H,11,12).
What are the key properties of N-(2-cyclobutylethyl)-2,2-difluoroacetamide?
N-(2-cyclobutylethyl)-2,2-difluoroacetamide has a molecular weight of 177.19 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutylethyl)-2,2-difluoroacetamide is sourced from PubChem (CID 103516050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).