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

C10H17F3N2O2 — CID 78886607

IUPACN-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
SMILESO=C(NCCO)C1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)7-15-4-1-8(2-5-15)9(17)14-3-6-16/h8,16H,1-7H2,(H,14,17)
InChIKeyBNCGZJJPVVRFHO-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.37
Rot. Bonds4

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

N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide (PubChem CID 78886607) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
PubChem CID78886607
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC NameN-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
SMILESO=C(NCCO)C1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)7-15-4-1-8(2-5-15)9(17)14-3-6-16/h8,16H,1-7H2,(H,14,17)
InChIKeyBNCGZJJPVVRFHO-UHFFFAOYSA-N
XLogP0.37
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide (CID 78886607) is N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide is O=C(NCCO)C1CCN(CC(F)(F)F)CC1.
What is the InChIKey of N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide?
The InChIKey is BNCGZJJPVVRFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c11-10(12,13)7-15-4-1-8(2-5-15)9(17)14-3-6-16/h8,16H,1-7H2,(H,14,17).
What are the key properties of N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide?
N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide has a molecular weight of 254.25 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide is sourced from PubChem (CID 78886607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).