1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine

C15H20F4N2 — CID 63035987

IUPAC1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2cc(C(F)(F)F)ccc2F)CC1
InChIInChI=1S/C15H20F4N2/c1-2-7-20-12-5-8-21(9-6-12)14-10-11(15(17,18)19)3-4-13(14)16/h3-4,10,12,20H,2,5-9H2,1H3
InChIKeyHPRKIMLJCZMXHO-UHFFFAOYSA-N
MW304.33 g/mol
LogP3.81
Rot. Bonds4

About 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine

1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine (PubChem CID 63035987) has the molecular formula C15H20F4N2 and a molecular weight of 304.33 g/mol. Its IUPAC name is 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine
PubChem CID63035987
Molecular FormulaC15H20F4N2
Molecular Weight304.33 g/mol
Exact Mass304.16
IUPAC Name1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2cc(C(F)(F)F)ccc2F)CC1
InChIInChI=1S/C15H20F4N2/c1-2-7-20-12-5-8-21(9-6-12)14-10-11(15(17,18)19)3-4-13(14)16/h3-4,10,12,20H,2,5-9H2,1H3
InChIKeyHPRKIMLJCZMXHO-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine 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

1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-methylpyrrolidin-3-amine
CID 63035988
1-[3-bromo-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine
CID 65491427
1-(4-fluoro-2-iodophenyl)-N-propylpiperidin-4-amine
CID 79766663
1-[2-chloro-5-(trifluoromethyl)phenyl]-N-ethylpyrrolidin-3-amine
CID 60862803
1-[4-chloro-3-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine
CID 60860788
1-[2-fluoro-5-(trifluoromethyl)phenyl]-N,2-dimethylpiperidin-4-amine
CID 63036677
N-ethyl-1-(2-fluorophenyl)piperidin-4-amine
CID 43315313
1-(2,6-difluorophenyl)-N-propylpyrrolidin-3-amine
CID 43315556
1-(5-chloro-2-methylphenyl)-N-ethylpiperidin-4-amine
CID 54927324
N-propyl-1-(3,4,5-trifluorophenyl)pyrrolidin-3-amine
CID 62809687
1-(5-tert-butyl-2-pyridinyl)-N-propylpiperidin-4-amine
CID 107874234
1-(2,5-dichlorophenyl)-N-propylpyrrolidin-3-amine
CID 60860793

Frequently Asked Questions

What is the IUPAC name of 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine?
The IUPAC name of 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine (CID 63035987) is 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine?
The canonical SMILES for 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine is CCCNC1CCN(c2cc(C(F)(F)F)ccc2F)CC1.
What is the InChIKey of 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine?
The InChIKey is HPRKIMLJCZMXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F4N2/c1-2-7-20-12-5-8-21(9-6-12)14-10-11(15(17,18)19)3-4-13(14)16/h3-4,10,12,20H,2,5-9H2,1H3.
What are the key properties of 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine?
1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine has a molecular weight of 304.33 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-fluoro-5-(trifluoromethyl)phenyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 63035987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).