3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide

C13H23F3N2O — CID 55211669

IUPAC3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCCN(CC(F)(F)F)C(=O)CCC1CCCCN1
InChIInChI=1S/C13H23F3N2O/c1-2-9-18(10-13(14,15)16)12(19)7-6-11-5-3-4-8-17-11/h11,17H,2-10H2,1H3
InChIKeyKEJSMVJSEBWFAD-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.71
Rot. Bonds6

About 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide

3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 55211669) has the molecular formula C13H23F3N2O and a molecular weight of 280.33 g/mol. Its IUPAC name is 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID55211669
Molecular FormulaC13H23F3N2O
Molecular Weight280.33 g/mol
Exact Mass280.18
IUPAC Name3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCCN(CC(F)(F)F)C(=O)CCC1CCCCN1
InChIInChI=1S/C13H23F3N2O/c1-2-9-18(10-13(14,15)16)12(19)7-6-11-5-3-4-8-17-11/h11,17H,2-10H2,1H3
InChIKeyKEJSMVJSEBWFAD-UHFFFAOYSA-N
XLogP2.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-methyl-3-piperidin-2-ylpropanamide
CID 62210320
2-[ethyl(3-piperidin-2-ylpropanoyl)amino]acetic acid
CID 62211166
3-cyclohexyl-N-methyl-N-(2-piperidin-2-ylethyl)propanamide
CID 43187165
3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide
CID 78858621
2-(cyclopentylamino)-N-propyl-N-(2,2,2-trifluoroethyl)acetamide
CID 60944875
3-cyclohexyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857392
2,2-difluoro-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625526
N-(2-cyanopropyl)-N-ethyl-3-piperidin-2-ylpropanamide
CID 55049291
N-propyl-N-(pyrrolidin-2-ylmethyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 106610292
N-ethyl-N-(oxolan-2-ylmethyl)-3-piperidin-2-ylpropanamide
CID 62211639
N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 55048264
2-cycloheptyl-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625612

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide (CID 55211669) is 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide is CCCN(CC(F)(F)F)C(=O)CCC1CCCCN1.
What is the InChIKey of 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is KEJSMVJSEBWFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23F3N2O/c1-2-9-18(10-13(14,15)16)12(19)7-6-11-5-3-4-8-17-11/h11,17H,2-10H2,1H3.
What are the key properties of 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide?
3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 280.33 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 55211669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).