N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine

C15H21F3N2 — CID 62880119

IUPACN-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
SMILESCCNC1CCN(Cc2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C15H21F3N2/c1-2-19-13-7-9-20(10-8-13)11-12-5-3-4-6-14(12)15(16,17)18/h3-6,13,19H,2,7-11H2,1H3
InChIKeyAVTMKBKWBXHVFO-UHFFFAOYSA-N
MW286.34 g/mol
LogP3.28
Rot. Bonds4

About N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine

N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine (PubChem CID 62880119) has the molecular formula C15H21F3N2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
PubChem CID62880119
Molecular FormulaC15H21F3N2
Molecular Weight286.34 g/mol
Exact Mass286.17
IUPAC NameN-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
SMILESCCNC1CCN(Cc2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C15H21F3N2/c1-2-19-13-7-9-20(10-8-13)11-12-5-3-4-6-14(12)15(16,17)18/h3-6,13,19H,2,7-11H2,1H3
InChIKeyAVTMKBKWBXHVFO-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
CID 18002013
N-methyl-1-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methanamine
CID 63250554
1-[(2,3-difluorophenyl)methyl]-N-ethylpiperidin-4-amine
CID 54923818
1-benzyl-N-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine
CID 55378502
N-methyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxamide
CID 42542209
N-benzyl-N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
CID 1329756
(3S)-N-[(2-methoxyphenyl)methyl]-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine
CID 91547218
N-(3-chloro-2-methylphenyl)-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
CID 3931119
N,N-dimethyl-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine
CID 90269557
N-ethyl-1-[2-(trifluoromethyl)phenyl]pyrrolidin-3-amine
CID 43315015
4-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]morpholine
CID 171691368
1-ethyl-N-[[2-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
CID 61171918

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine?
The IUPAC name of N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine (CID 62880119) is N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine?
The canonical SMILES for N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine is CCNC1CCN(Cc2ccccc2C(F)(F)F)CC1.
What is the InChIKey of N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine?
The InChIKey is AVTMKBKWBXHVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2/c1-2-19-13-7-9-20(10-8-13)11-12-5-3-4-6-14(12)15(16,17)18/h3-6,13,19H,2,7-11H2,1H3.
What are the key properties of N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine?
N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine has a molecular weight of 286.34 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine is sourced from PubChem (CID 62880119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).