4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol

C10H19F3N2O — CID 62222037

IUPAC4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol
SMILESCCN(CC(F)(F)F)CC1(O)CCNCC1
InChIInChI=1S/C10H19F3N2O/c1-2-15(8-10(11,12)13)7-9(16)3-5-14-6-4-9/h14,16H,2-8H2,1H3
InChIKeyNOCRNDYRDSYCAO-UHFFFAOYSA-N
MW240.27 g/mol
LogP0.99
Rot. Bonds4

About 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol

4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol (PubChem CID 62222037) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol
PubChem CID62222037
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol
SMILESCCN(CC(F)(F)F)CC1(O)CCNCC1
InChIInChI=1S/C10H19F3N2O/c1-2-15(8-10(11,12)13)7-9(16)3-5-14-6-4-9/h14,16H,2-8H2,1H3
InChIKeyNOCRNDYRDSYCAO-UHFFFAOYSA-N
XLogP0.99
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol?
The IUPAC name of 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol (CID 62222037) is 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol.
What is the SMILES notation for 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol?
The canonical SMILES for 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol is CCN(CC(F)(F)F)CC1(O)CCNCC1.
What is the InChIKey of 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol?
The InChIKey is NOCRNDYRDSYCAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-2-15(8-10(11,12)13)7-9(16)3-5-14-6-4-9/h14,16H,2-8H2,1H3.
What are the key properties of 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol?
4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol has a molecular weight of 240.27 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]piperidin-4-ol is sourced from PubChem (CID 62222037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).