N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine

C14H26F3N3O — CID 79177181

IUPACN-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCCN1CCOC(CN(CC(F)(F)F)C2CCNCC2)C1
InChIInChI=1S/C14H26F3N3O/c1-2-19-7-8-21-13(9-19)10-20(11-14(15,16)17)12-3-5-18-6-4-12/h12-13,18H,2-11H2,1H3
InChIKeyLRNLHDDXGOLPFZ-UHFFFAOYSA-N
MW309.38 g/mol
LogP1.32
Rot. Bonds5

About N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine

N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine (PubChem CID 79177181) has the molecular formula C14H26F3N3O and a molecular weight of 309.38 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine
PubChem CID79177181
Molecular FormulaC14H26F3N3O
Molecular Weight309.38 g/mol
Exact Mass309.20
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCCN1CCOC(CN(CC(F)(F)F)C2CCNCC2)C1
InChIInChI=1S/C14H26F3N3O/c1-2-19-7-8-21-13(9-19)10-20(11-14(15,16)17)12-3-5-18-6-4-12/h12-13,18H,2-11H2,1H3
InChIKeyLRNLHDDXGOLPFZ-UHFFFAOYSA-N
XLogP1.32
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine (CID 79177181) is N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine is CCN1CCOC(CN(CC(F)(F)F)C2CCNCC2)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
The InChIKey is LRNLHDDXGOLPFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F3N3O/c1-2-19-7-8-21-13(9-19)10-20(11-14(15,16)17)12-3-5-18-6-4-12/h12-13,18H,2-11H2,1H3.
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine?
N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine has a molecular weight of 309.38 g/mol, XLogP of 1.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)piperidin-4-amine is sourced from PubChem (CID 79177181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).