4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide

C12H19F3N2O3 — CID 75483152

IUPAC4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCC1OCCC1NC(=O)N1CCC(O)(C(F)(F)F)CC1
InChIInChI=1S/C12H19F3N2O3/c1-8-9(2-7-20-8)16-10(18)17-5-3-11(19,4-6-17)12(13,14)15/h8-9,19H,2-7H2,1H3,(H,16,18)
InChIKeyWFOIGZFGPHFGSP-UHFFFAOYSA-N
MW296.29 g/mol
LogP1.26
Rot. Bonds1

About 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide

4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide (PubChem CID 75483152) has the molecular formula C12H19F3N2O3 and a molecular weight of 296.29 g/mol. Its IUPAC name is 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
PubChem CID75483152
Molecular FormulaC12H19F3N2O3
Molecular Weight296.29 g/mol
Exact Mass296.13
IUPAC Name4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCC1OCCC1NC(=O)N1CCC(O)(C(F)(F)F)CC1
InChIInChI=1S/C12H19F3N2O3/c1-8-9(2-7-20-8)16-10(18)17-5-3-11(19,4-6-17)12(13,14)15/h8-9,19H,2-7H2,1H3,(H,16,18)
InChIKeyWFOIGZFGPHFGSP-UHFFFAOYSA-N
XLogP1.26
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The IUPAC name of 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide (CID 75483152) is 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide is CC1OCCC1NC(=O)N1CCC(O)(C(F)(F)F)CC1.
What is the InChIKey of 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The InChIKey is WFOIGZFGPHFGSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N2O3/c1-8-9(2-7-20-8)16-10(18)17-5-3-11(19,4-6-17)12(13,14)15/h8-9,19H,2-7H2,1H3,(H,16,18).
What are the key properties of 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide has a molecular weight of 296.29 g/mol, XLogP of 1.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide is sourced from PubChem (CID 75483152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).