2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide

C10H16F4N2O — CID 113265645

IUPAC2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide
SMILESO=C(NCCC1CCCNC1)C(F)(F)C(F)F
InChIInChI=1S/C10H16F4N2O/c11-8(12)10(13,14)9(17)16-5-3-7-2-1-4-15-6-7/h7-8,15H,1-6H2,(H,16,17)
InChIKeyTYWCXVAFYXEYFN-UHFFFAOYSA-N
MW256.24 g/mol
LogP1.39
Rot. Bonds5

About 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide

2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide (PubChem CID 113265645) has the molecular formula C10H16F4N2O and a molecular weight of 256.24 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide
PubChem CID113265645
Molecular FormulaC10H16F4N2O
Molecular Weight256.24 g/mol
Exact Mass256.12
IUPAC Name2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide
SMILESO=C(NCCC1CCCNC1)C(F)(F)C(F)F
InChIInChI=1S/C10H16F4N2O/c11-8(12)10(13,14)9(17)16-5-3-7-2-1-4-15-6-7/h7-8,15H,1-6H2,(H,16,17)
InChIKeyTYWCXVAFYXEYFN-UHFFFAOYSA-N
XLogP1.39
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.24
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(methanesulfonamido)-2-methyl-N-(2-piperidin-3-ylethyl)propanamide
CID 119558362
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
2,2,3,3-tetrafluoro-N-piperidin-3-ylpropanamide
CID 103805389
2-cyclopropyl-N-(2-piperidin-3-ylethyl)acetamide
CID 63628201
2,3-dimethyl-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119555477
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479536
2-cyclohexyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260693
2-cycloheptyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119557821
3-cyclopentyl-N-[2-oxo-2-(2-piperidin-3-ylethylamino)ethyl]propanamide
CID 119555898
4,4,4-trifluoro-3-phenyl-N-(2-piperidin-3-ylethyl)butanamide
CID 119557143
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119556041

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide (CID 113265645) is 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide is O=C(NCCC1CCCNC1)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide?
The InChIKey is TYWCXVAFYXEYFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F4N2O/c11-8(12)10(13,14)9(17)16-5-3-7-2-1-4-15-6-7/h7-8,15H,1-6H2,(H,16,17).
What are the key properties of 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide?
2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide has a molecular weight of 256.24 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide is sourced from PubChem (CID 113265645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).