Skip to content

N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide

C19H25F3N2O — CID 171336017

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACN-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide
SMILESCN(C(=O)C1CCC1)C1CCN(Cc2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C19H25F3N2O/c1-23(18(25)14-6-4-7-14)16-9-11-24(12-10-16)13-15-5-2-3-8-17(15)19(20,21)22/h2-3,5,8,14,16H,4,6-7,9-13H2,1H3
InChIKeyFREXTLHYSMRRQV-UHFFFAOYSA-N
MW354.42 g/mol
LogP3.93
Rot. Bonds4

About N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide

N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide (PubChem CID 171336017) has the molecular formula C19H25F3N2O and a molecular weight of 354.42 g/mol. Its IUPAC name is N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide
PubChem CID171336017
Molecular FormulaC19H25F3N2O
Molecular Weight354.42 g/mol
Exact Mass354.19
IUPAC NameN-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide
SMILESCN(C(=O)C1CCC1)C1CCN(Cc2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C19H25F3N2O/c1-23(18(25)14-6-4-7-14)16-9-11-24(12-10-16)13-15-5-2-3-8-17(15)19(20,21)22/h2-3,5,8,14,16H,4,6-7,9-13H2,1H3
InChIKeyFREXTLHYSMRRQV-UHFFFAOYSA-N
XLogP3.93
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.42
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide?
The IUPAC name of N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide (CID 171336017) is N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide?
The canonical SMILES for N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide is CN(C(=O)C1CCC1)C1CCN(Cc2ccccc2C(F)(F)F)CC1.
What is the InChIKey of N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide?
The InChIKey is FREXTLHYSMRRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25F3N2O/c1-23(18(25)14-6-4-7-14)16-9-11-24(12-10-16)13-15-5-2-3-8-17(15)19(20,21)22/h2-3,5,8,14,16H,4,6-7,9-13H2,1H3.
What are the key properties of N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide?
N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide has a molecular weight of 354.42 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]cyclobutanecarboxamide is sourced from PubChem (CID 171336017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.