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

C8H12F3NO — CID 115673150

IUPACN-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide
SMILESCCC1(NC(=O)C(F)(F)F)CCC1
InChIInChI=1S/C8H12F3NO/c1-2-7(4-3-5-7)12-6(13)8(9,10)11/h2-5H2,1H3,(H,12,13)
InChIKeyMUYWIWIGDJYTBI-UHFFFAOYSA-N
MW195.18 g/mol
LogP2.00
Rot. Bonds2

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

N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide (PubChem CID 115673150) has the molecular formula C8H12F3NO and a molecular weight of 195.18 g/mol. Its IUPAC name is N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide
PubChem CID115673150
Molecular FormulaC8H12F3NO
Molecular Weight195.18 g/mol
Exact Mass195.09
IUPAC NameN-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide
SMILESCCC1(NC(=O)C(F)(F)F)CCC1
InChIInChI=1S/C8H12F3NO/c1-2-7(4-3-5-7)12-6(13)8(9,10)11/h2-5H2,1H3,(H,12,13)
InChIKeyMUYWIWIGDJYTBI-UHFFFAOYSA-N
XLogP2.00
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 ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-[(2,2,2-trifluoroacetyl)amino]cyclobutyl]acetic acid
CID 79846628
N-(1-ethylcyclopentyl)-2,2-dimethylpropanamide
CID 58542277
2-[1-[(2,2,2-trifluoroacetyl)amino]cyclohexyl]acetic acid
CID 64672154
N-[(1-ethylcyclopentyl)methyl]-2,2,2-trifluoroacetamide
CID 103766554
N-[1-(3-bromo-2-oxopropyl)cyclohexyl]-2,2,2-trifluoroacetamide
CID 104701432
4-[(1-ethylcyclobutyl)amino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 104866198
N-(1-ethylcyclobutyl)-2-(N'-hydroxycarbamimidoyl)-2-methylbutanamide
CID 104866315
3-amino-N-(1-ethylcyclobutyl)-3-methylbutanamide
CID 115739871
(2S)-2-amino-N-(1-ethylcyclobutyl)-3,3-dimethylbutanamide
CID 104866235
3-[(1-ethylcyclobutyl)amino]-2-methyl-3-oxopropanoic acid
CID 114899021
N-(1-ethylcyclopropyl)acetamide
CID 67691252
1-cyclobutyl-3-(1-ethylcyclobutyl)urea
CID 115673198

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide?
The IUPAC name of N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide (CID 115673150) is N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide?
The canonical SMILES for N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide is CCC1(NC(=O)C(F)(F)F)CCC1.
What is the InChIKey of N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide?
The InChIKey is MUYWIWIGDJYTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO/c1-2-7(4-3-5-7)12-6(13)8(9,10)11/h2-5H2,1H3,(H,12,13).
What are the key properties of N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide?
N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide has a molecular weight of 195.18 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylcyclobutyl)-2,2,2-trifluoroacetamide is sourced from PubChem (CID 115673150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).