N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide

C11H19F3N2O2 — CID 107479096

IUPACN-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)N(CCO)CC(F)(F)F)CC1
InChIInChI=1S/C11H19F3N2O2/c1-9-2-4-15(5-3-9)10(18)16(6-7-17)8-11(12,13)14/h9,17H,2-8H2,1H3
InChIKeyWDXFYIQFTAIQGM-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.69
Rot. Bonds3

About N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide

N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide (PubChem CID 107479096) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
PubChem CID107479096
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC NameN-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)N(CCO)CC(F)(F)F)CC1
InChIInChI=1S/C11H19F3N2O2/c1-9-2-4-15(5-3-9)10(18)16(6-7-17)8-11(12,13)14/h9,17H,2-8H2,1H3
InChIKeyWDXFYIQFTAIQGM-UHFFFAOYSA-N
XLogP1.69
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-propyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 116655130
3-N-(2-hydroxyethyl)-3-N-(2,2,2-trifluoroethyl)piperidine-1,3-dicarboxamide
CID 103750590
4-N,4-N-bis(2-hydroxyethyl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 61233622
(2R,4R)-4-hydroxy-1-[2-hydroxyethyl(2,2,2-trifluoroethyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 107481998
3-[2-hydroxyethyl(2,2,2-trifluoroethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 107482291
ethyl 2-[(4-methylpiperidine-1-carbonyl)-propylamino]acetate
CID 79162765
2-[1-[propyl(2,2,2-trifluoroethyl)carbamoyl]azetidin-3-yl]propanoic acid
CID 116683169
3-cyclohexyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 103857392
N,4-dimethyl-N-pentylpiperidine-1-carboxamide
CID 116654214
4-methyl-N-propan-2-yl-N-propylpiperidine-1-carboxamide
CID 116654160
2-[azepane-1-carbonyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258890
2-[[amino-(4-methylpiperidin-1-yl)methylidene]amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide;hydroiodide
CID 111464973

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide (CID 107479096) is N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide is CC1CCN(C(=O)N(CCO)CC(F)(F)F)CC1.
What is the InChIKey of N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
The InChIKey is WDXFYIQFTAIQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-9-2-4-15(5-3-9)10(18)16(6-7-17)8-11(12,13)14/h9,17H,2-8H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide has a molecular weight of 268.28 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide is sourced from PubChem (CID 107479096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).