6-(trifluoromethyl)piperidin-3-amine

C6H11F3N2 — CID 42628739

IUPAC6-(trifluoromethyl)piperidin-3-amine
SMILESNC1CCC(C(F)(F)F)NC1
InChIInChI=1S/C6H11F3N2/c7-6(8,9)5-2-1-4(10)3-11-5/h4-5,11H,1-3,10H2
InChIKeyDTYKPJTZKOJUHO-UHFFFAOYSA-N
MW168.16 g/mol
LogP0.63
Rot. Bonds

About 6-(trifluoromethyl)piperidin-3-amine

6-(trifluoromethyl)piperidin-3-amine (PubChem CID 42628739) has the molecular formula C6H11F3N2 and a molecular weight of 168.16 g/mol. Its IUPAC name is 6-(trifluoromethyl)piperidin-3-amine.

Molecular Properties

Compound Name6-(trifluoromethyl)piperidin-3-amine
PubChem CID42628739
Molecular FormulaC6H11F3N2
Molecular Weight168.16 g/mol
Exact Mass168.09
IUPAC Name6-(trifluoromethyl)piperidin-3-amine
SMILESNC1CCC(C(F)(F)F)NC1
InChIInChI=1S/C6H11F3N2/c7-6(8,9)5-2-1-4(10)3-11-5/h4-5,11H,1-3,10H2
InChIKeyDTYKPJTZKOJUHO-UHFFFAOYSA-N
XLogP0.63
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Piperidine-2-methylamine
CID 90865
2-(Trifluoromethyl)piperidine
CID 11263608
Piperidin-3-amine
CID 148119
(3R)-piperidin-3-amine
CID 667606
2-(Trifluoromethyl)piperazine
CID 18519725
1-(2,2,2-Trifluoroethyl)piperidin-4-amine
CID 16228722
1-(2,2-Difluoroethyl)-4-piperidinamine
CID 25252389
2-(4,4-Difluoropiperidin-1-yl)ethan-1-amine
CID 2758354
2-(1,1-Difluoroethyl)piperazine
CID 19763581
(2S)-2-(Trifluoromethyl)piperidine
CID 42580051
(2R)-2-(Trifluoromethyl)piperidine
CID 42580053
2-(2,2,2-Trifluoroethyl)piperazine
CID 54215917

Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)piperidin-3-amine?
The IUPAC name of 6-(trifluoromethyl)piperidin-3-amine (CID 42628739) is 6-(trifluoromethyl)piperidin-3-amine.
What is the SMILES notation for 6-(trifluoromethyl)piperidin-3-amine?
The canonical SMILES for 6-(trifluoromethyl)piperidin-3-amine is NC1CCC(C(F)(F)F)NC1.
What is the InChIKey of 6-(trifluoromethyl)piperidin-3-amine?
The InChIKey is DTYKPJTZKOJUHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2/c7-6(8,9)5-2-1-4(10)3-11-5/h4-5,11H,1-3,10H2.
What are the key properties of 6-(trifluoromethyl)piperidin-3-amine?
6-(trifluoromethyl)piperidin-3-amine has a molecular weight of 168.16 g/mol, XLogP of 0.63, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)piperidin-3-amine is sourced from PubChem (CID 42628739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).