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

C10H17F3N2O3 — CID 115769626

IUPAC4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
SMILESO=C(NCC(F)(F)F)N1CCC(OCCO)CC1
InChIInChI=1S/C10H17F3N2O3/c11-10(12,13)7-14-9(17)15-3-1-8(2-4-15)18-6-5-16/h8,16H,1-7H2,(H,14,17)
InChIKeySHVVQQNISUGRKA-UHFFFAOYSA-N
MW270.25 g/mol
LogP0.73
Rot. Bonds4

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

4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide (PubChem CID 115769626) has the molecular formula C10H17F3N2O3 and a molecular weight of 270.25 g/mol. Its IUPAC name is 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
PubChem CID115769626
Molecular FormulaC10H17F3N2O3
Molecular Weight270.25 g/mol
Exact Mass270.12
IUPAC Name4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
SMILESO=C(NCC(F)(F)F)N1CCC(OCCO)CC1
InChIInChI=1S/C10H17F3N2O3/c11-10(12,13)7-14-9(17)15-3-1-8(2-4-15)18-6-5-16/h8,16H,1-7H2,(H,14,17)
InChIKeySHVVQQNISUGRKA-UHFFFAOYSA-N
XLogP0.73
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(trifluoromethoxy)piperidine-1-carboxamide
CID 174247751
2-[1-(2,2,2-Trifluoroethylcarbamoyl)piperidin-4-yl]oxyacetic acid
CID 55251438
2-[1-(3,3,3-Trifluoropropylcarbamoyl)piperidin-4-yl]oxyacetic acid
CID 63875258
2-(hydroxymethyl)-6-methyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
CID 102932397
N-(3,3-difluoro-2-hydroxypropyl)piperidine-1-carboxamide
CID 103731761
N-(2,2-difluoro-3-hydroxypropyl)piperidine-1-carboxamide
CID 104858649
2-[1-(2,2,3,3-Tetrafluoropropylcarbamoyl)piperidin-4-yl]oxyacetic acid
CID 106295210
4-ethoxy-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 113226527
2-[1-(2,2-Difluoroethylcarbamoyl)piperidin-4-yl]oxyacetic acid
CID 113303933
6-(hydroxymethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
CID 114776584
2-[1-(4,4,4-Trifluorobutylcarbamoyl)piperidin-4-yl]oxyacetic acid
CID 115521214
4-methoxy-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 115576305

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
The IUPAC name of 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide (CID 115769626) is 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide is O=C(NCC(F)(F)F)N1CCC(OCCO)CC1.
What is the InChIKey of 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
The InChIKey is SHVVQQNISUGRKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O3/c11-10(12,13)7-14-9(17)15-3-1-8(2-4-15)18-6-5-16/h8,16H,1-7H2,(H,14,17).
What are the key properties of 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide?
4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide has a molecular weight of 270.25 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethoxy)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide is sourced from PubChem (CID 115769626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).