1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid

C21H25F3N2O2 — CID 22182392

IUPAC1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid
SMILESNC1CCN(CC(c2ccccc2)c2ccccc2)CC1.O=C(O)C(F)(F)F
InChIInChI=1S/C19H24N2.C2HF3O2/c20-18-11-13-21(14-12-18)15-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17;3-2(4,5)1(6)7/h1-10,18-19H,11-15,20H2;(H,6,7)
InChIKeyAGXRNVHYXRIDFO-UHFFFAOYSA-N
MW394.44 g/mol
LogP3.87
Rot. Bonds4

About 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid

1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid (PubChem CID 22182392) has the molecular formula C21H25F3N2O2 and a molecular weight of 394.44 g/mol. Its IUPAC name is 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid
PubChem CID22182392
Molecular FormulaC21H25F3N2O2
Molecular Weight394.44 g/mol
Exact Mass394.19
IUPAC Name1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid
SMILESNC1CCN(CC(c2ccccc2)c2ccccc2)CC1.O=C(O)C(F)(F)F
InChIInChI=1S/C19H24N2.C2HF3O2/c20-18-11-13-21(14-12-18)15-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17;3-2(4,5)1(6)7/h1-10,18-19H,11-15,20H2;(H,6,7)
InChIKeyAGXRNVHYXRIDFO-UHFFFAOYSA-N
XLogP3.87
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.44
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[2-[3-(aminomethyl)phenyl]phenyl]methyl]-1-benzylpiperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534700
N-[[2-[4-(aminomethyl)phenyl]phenyl]methyl]-1-benzylpiperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534702
1-benzyl-N-[[2-[3-[(2-methylpropylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534704
1-benzyl-N-[[2-[4-[(2-methylpropylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534706
1-benzyl-N-[[2-[3-[(cyclopentylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534710
1-benzyl-N-[[2-[4-[(cyclopentylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534712
N-[[3-[3-(aminomethyl)phenyl]phenyl]methyl]-1-benzylpiperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534720
N-[[3-[4-(aminomethyl)phenyl]phenyl]methyl]-1-benzylpiperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534722
1-benzyl-N-[[3-[3-[(2-methylpropylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534724
1-benzyl-N-[[3-[4-[(2-methylpropylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534726
1-benzyl-N-[[4-[3-[(2-methylpropylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534740
1-benzyl-N-[[4-[4-[(2-methylpropylamino)methyl]phenyl]phenyl]methyl]piperidin-4-amine;2,2,2-trifluoroacetic acid
CID 44534742

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid?
The IUPAC name of 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid (CID 22182392) is 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid.
What is the SMILES notation for 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid?
The canonical SMILES for 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid is NC1CCN(CC(c2ccccc2)c2ccccc2)CC1.O=C(O)C(F)(F)F.
What is the InChIKey of 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid?
The InChIKey is AGXRNVHYXRIDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2.C2HF3O2/c20-18-11-13-21(14-12-18)15-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17;3-2(4,5)1(6)7/h1-10,18-19H,11-15,20H2;(H,6,7).
What are the key properties of 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid?
1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid has a molecular weight of 394.44 g/mol, XLogP of 3.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-diphenylethyl)piperidin-4-amine;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 22182392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).