2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide

C11H16F3NO — CID 86833481

IUPAC2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide
SMILESCN(CCC(F)(F)F)C(=O)CC1C=CCC1
InChIInChI=1S/C11H16F3NO/c1-15(7-6-11(12,13)14)10(16)8-9-4-2-3-5-9/h2,4,9H,3,5-8H2,1H3
InChIKeyRAGMOFVYOSXZFT-UHFFFAOYSA-N
MW235.25 g/mol
LogP2.75
Rot. Bonds4

About 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide

2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide (PubChem CID 86833481) has the molecular formula C11H16F3NO and a molecular weight of 235.25 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide
PubChem CID86833481
Molecular FormulaC11H16F3NO
Molecular Weight235.25 g/mol
Exact Mass235.12
IUPAC Name2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide
SMILESCN(CCC(F)(F)F)C(=O)CC1C=CCC1
InChIInChI=1S/C11H16F3NO/c1-15(7-6-11(12,13)14)10(16)8-9-4-2-3-5-9/h2,4,9H,3,5-8H2,1H3
InChIKeyRAGMOFVYOSXZFT-UHFFFAOYSA-N
XLogP2.75
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Pyrrolidine, 1-((6-methyl-3-cyclohexen-1-yl)carbonyl)-
CID 3050744
2-[(1R)-cyclopent-2-en-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
CID 39969447
1-(azocan-1-yl)-2-[(1R)-cyclopent-2-en-1-yl]ethanone
CID 40053954
2-[(1R)-cyclopent-2-en-1-yl]-N-cyclopentyl-N-methylacetamide
CID 40137759
Cyclohex-3-en-1-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone
CID 45800434
cyclopent-3-en-1-yl-[(4S)-4-methylazepan-1-yl]methanone
CID 97092455
2-[(1R)-cyclopent-2-en-1-yl]-N-ethyl-N-(2,2,2-trifluoroethyl)acetamide
CID 97864631
(1S)-N-(cyclopentylmethyl)-N-methylcyclohex-3-ene-1-carboxamide
CID 99616323
cyclopenten-1-yl-[(3S)-4,4-difluoro-3-methylpiperidin-1-yl]methanone
CID 129349149
[(1S)-cyclohex-3-en-1-yl]-[3-(difluoromethyl)azetidin-1-yl]methanone
CID 164639471
N-[[(1R,4R)-4-(2-amino-2-oxoethyl)cyclopent-2-en-1-yl]methyl]-2,2,2-trifluoroacetamide
CID 89472517
3-[(5S)-3,5-difluorocyclohex-3-en-1-yl]-N-[(1S)-4-methylcyclohex-2-en-1-yl]-N-propylpropanamide
CID 122647561

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide (CID 86833481) is 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide is CN(CCC(F)(F)F)C(=O)CC1C=CCC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide?
The InChIKey is RAGMOFVYOSXZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F3NO/c1-15(7-6-11(12,13)14)10(16)8-9-4-2-3-5-9/h2,4,9H,3,5-8H2,1H3.
What are the key properties of 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide?
2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide has a molecular weight of 235.25 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide is sourced from PubChem (CID 86833481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).