4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine

C10H20F3N3O — CID 123775383

IUPAC4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine
SMILESCN(C)CCOC1CC(C(F)(F)F)NCC1N
InChIInChI=1S/C10H20F3N3O/c1-16(2)3-4-17-8-5-9(10(11,12)13)15-6-7(8)14/h7-9,15H,3-6,14H2,1-2H3
InChIKeyBDBYYZNTIQMECH-UHFFFAOYSA-N
MW255.28 g/mol
LogP0.18
Rot. Bonds4

About 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine

4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine (PubChem CID 123775383) has the molecular formula C10H20F3N3O and a molecular weight of 255.28 g/mol. Its IUPAC name is 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine.

Molecular Properties

Compound Name4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine
PubChem CID123775383
Molecular FormulaC10H20F3N3O
Molecular Weight255.28 g/mol
Exact Mass255.16
IUPAC Name4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine
SMILESCN(C)CCOC1CC(C(F)(F)F)NCC1N
InChIInChI=1S/C10H20F3N3O/c1-16(2)3-4-17-8-5-9(10(11,12)13)15-6-7(8)14/h7-9,15H,3-6,14H2,1-2H3
InChIKeyBDBYYZNTIQMECH-UHFFFAOYSA-N
XLogP0.18
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine?
The IUPAC name of 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine (CID 123775383) is 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine.
What is the SMILES notation for 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine?
The canonical SMILES for 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine is CN(C)CCOC1CC(C(F)(F)F)NCC1N.
What is the InChIKey of 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine?
The InChIKey is BDBYYZNTIQMECH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3N3O/c1-16(2)3-4-17-8-5-9(10(11,12)13)15-6-7(8)14/h7-9,15H,3-6,14H2,1-2H3.
What are the key properties of 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine?
4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine has a molecular weight of 255.28 g/mol, XLogP of 0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)piperidin-3-amine is sourced from PubChem (CID 123775383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).