N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide

C12H21F3N2O — CID 55048264

IUPACN-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCN(CC(F)(F)F)C(=O)CCC1CCNCC1
InChIInChI=1S/C12H21F3N2O/c1-2-17(9-12(13,14)15)11(18)4-3-10-5-7-16-8-6-10/h10,16H,2-9H2,1H3
InChIKeyUYDUWVYPZOVGNH-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.18
Rot. Bonds5

About N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide

N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 55048264) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID55048264
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC NameN-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCN(CC(F)(F)F)C(=O)CCC1CCNCC1
InChIInChI=1S/C12H21F3N2O/c1-2-17(9-12(13,14)15)11(18)4-3-10-5-7-16-8-6-10/h10,16H,2-9H2,1H3
InChIKeyUYDUWVYPZOVGNH-UHFFFAOYSA-N
XLogP2.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-N-ethyl-N-(2,2,2-trifluoroethyl)propanamide
CID 78858621
N-ethyl-3-piperidin-4-yl-N-propylpropanamide
CID 62210157
3-cyclohexyl-N-ethyl-N-(piperidin-4-ylmethyl)propanamide
CID 79720313
N-[3-(diethylamino)propyl]-N-ethyl-3-piperidin-4-ylpropanamide
CID 102992986
N-[2-(dimethylamino)ethyl]-N-methyl-3-piperidin-4-ylpropanamide
CID 55227726
3-cyclopentyl-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
CID 43603427
N-(cyclopropylmethyl)-3-piperidin-4-yl-N-propylpropanamide
CID 62211914
N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
CID 62210682
N-methyl-3-piperidin-4-yl-N-propan-2-ylpropanamide
CID 62211368
2-[methyl(3-piperidin-4-ylpropanoyl)amino]acetic acid
CID 62212379
3-cyclohexyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857392
N,N-diethyl-2-(2-piperidin-4-ylethylsulfinyl)acetamide
CID 112741796

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide (CID 55048264) is N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide is CCN(CC(F)(F)F)C(=O)CCC1CCNCC1.
What is the InChIKey of N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is UYDUWVYPZOVGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c1-2-17(9-12(13,14)15)11(18)4-3-10-5-7-16-8-6-10/h10,16H,2-9H2,1H3.
What are the key properties of N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 266.31 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 55048264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).