N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide

C9H11F6NO — CID 103310113

IUPACN-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
SMILESO=C(NC1CCCC1)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C9H11F6NO/c10-8(11,12)6(9(13,14)15)7(17)16-5-3-1-2-4-5/h5-6H,1-4H2,(H,16,17)
InChIKeyDGABCYHPUNFGQA-UHFFFAOYSA-N
MW263.18 g/mol
LogP2.79
Rot. Bonds2

About N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide

N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide (PubChem CID 103310113) has the molecular formula C9H11F6NO and a molecular weight of 263.18 g/mol. Its IUPAC name is N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
PubChem CID103310113
Molecular FormulaC9H11F6NO
Molecular Weight263.18 g/mol
Exact Mass263.07
IUPAC NameN-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
SMILESO=C(NC1CCCC1)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C9H11F6NO/c10-8(11,12)6(9(13,14)15)7(17)16-5-3-1-2-4-5/h5-6H,1-4H2,(H,16,17)
InChIKeyDGABCYHPUNFGQA-UHFFFAOYSA-N
XLogP2.79
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.18
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3,3-trifluoro-N-[(1S,2S)-2-hydroxycyclohexyl]-2-(trifluoromethyl)propanamide
CID 103310253
N-[(1R,2R)-2-aminocyclohexyl]-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103310467
N-cyclopentyl-2,2-difluoroacetamide
CID 103600661
N-[2-(aminomethyl)cyclohexyl]-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103310394
N,N'-di(cycloheptyl)-2,3-dihydroxybutanediamide
CID 141089668
(2S)-N-cyclohexyl-2-[4-[(2S)-1,1,1-trifluoropropan-2-yl]piperazin-1-yl]propanamide
CID 124612307
3,3,3-trifluoro-N-(6-methylpiperidin-3-yl)-2-(trifluoromethyl)propanamide
CID 103309477
N-[cyano(cyclohexyl)methyl]-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103309839
N-[2-(aminomethyl)cyclopentyl]-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103308995
N,N'-dicyclopentyl-2,2,3,3,4,4,5,5-octafluorohexanediamide
CID 4201164
N-cyclohexyl-2-silylpropanamide
CID 123581134
N-cyclobutyl-3,3-difluoro-2-methylbutanamide
CID 131064773

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
The IUPAC name of N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide (CID 103310113) is N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide.
What is the SMILES notation for N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
The canonical SMILES for N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide is O=C(NC1CCCC1)C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
The InChIKey is DGABCYHPUNFGQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F6NO/c10-8(11,12)6(9(13,14)15)7(17)16-5-3-1-2-4-5/h5-6H,1-4H2,(H,16,17).
What are the key properties of N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide?
N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide has a molecular weight of 263.18 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide is sourced from PubChem (CID 103310113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).