N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine

C14H26F3N3O — CID 43779516

IUPACN-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC(CN1CCOCC1)NC1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C14H26F3N3O/c1-12(10-19-6-8-21-9-7-19)18-13-2-4-20(5-3-13)11-14(15,16)17/h12-13,18H,2-11H2,1H3
InChIKeyCLSGFSCIFUKOSM-UHFFFAOYSA-N
MW309.38 g/mol
LogP1.32
Rot. Bonds5

About N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine

N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine (PubChem CID 43779516) has the molecular formula C14H26F3N3O and a molecular weight of 309.38 g/mol. Its IUPAC name is N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
PubChem CID43779516
Molecular FormulaC14H26F3N3O
Molecular Weight309.38 g/mol
Exact Mass309.20
IUPAC NameN-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
SMILESCC(CN1CCOCC1)NC1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C14H26F3N3O/c1-12(10-19-6-8-21-9-7-19)18-13-2-4-20(5-3-13)11-14(15,16)17/h12-13,18H,2-11H2,1H3
InChIKeyCLSGFSCIFUKOSM-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-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine (CID 43779516) is N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine.
What is the SMILES notation for N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The canonical SMILES for N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine is CC(CN1CCOCC1)NC1CCN(CC(F)(F)F)CC1.
What is the InChIKey of N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
The InChIKey is CLSGFSCIFUKOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F3N3O/c1-12(10-19-6-8-21-9-7-19)18-13-2-4-20(5-3-13)11-14(15,16)17/h12-13,18H,2-11H2,1H3.
What are the key properties of N-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine?
N-(1-morpholin-4-ylpropan-2-yl)-1-(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-(1-morpholin-4-ylpropan-2-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine is sourced from PubChem (CID 43779516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).