3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide

C12H20F3NO — CID 78858621

IUPAC3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCN(CC(F)(F)F)C(=O)CCC1CCCC1
InChIInChI=1S/C12H20F3NO/c1-2-16(9-12(13,14)15)11(17)8-7-10-5-3-4-6-10/h10H,2-9H2,1H3
InChIKeyWDROTUMMFGNTRE-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.37
Rot. Bonds5

About 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide

3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 78858621) has the molecular formula C12H20F3NO and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID78858621
Molecular FormulaC12H20F3NO
Molecular Weight251.29 g/mol
Exact Mass251.15
IUPAC Name3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCN(CC(F)(F)F)C(=O)CCC1CCCC1
InChIInChI=1S/C12H20F3NO/c1-2-16(9-12(13,14)15)11(17)8-7-10-5-3-4-6-10/h10H,2-9H2,1H3
InChIKeyWDROTUMMFGNTRE-UHFFFAOYSA-N
XLogP3.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 55048264
3-cyclohexyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857392
3-cyclopentyl-N-ethyl-N-prop-2-ynylpropanamide
CID 78970322
3-cyclopentyl-N-[2-(diethylamino)-2-oxoethyl]-N-methylpropanamide
CID 86908098
2-cyclohexyloxy-N-ethyl-N-(2,2,2-trifluoroethyl)acetamide
CID 78888415
3-cyclohexyl-N-ethyl-N-(piperidin-4-ylmethyl)propanamide
CID 79720313
3-cyclopentyl-N,N-dipentylpropanamide
CID 4248024
4-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)butanamide
CID 63308729
3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide
CID 55211669
3-cyclopentyl-N,N-diheptylpropanamide
CID 532988
3-cyclopentyl-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 43603427
N-[(4-aminophenyl)methyl]-3-cyclopentyl-N-ethylpropanamide
CID 43458719

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide (CID 78858621) is 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide is CCN(CC(F)(F)F)C(=O)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is WDROTUMMFGNTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F3NO/c1-2-16(9-12(13,14)15)11(17)8-7-10-5-3-4-6-10/h10H,2-9H2,1H3.
What are the key properties of 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide?
3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 251.29 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 78858621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).