1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine

C14H19F3N2 — CID 174580283

IUPAC1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine
SMILESCc1c(NC2CCN(C)CC2)cccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c1-10-12(14(15,16)17)4-3-5-13(10)18-11-6-8-19(2)9-7-11/h3-5,11,18H,6-9H2,1-2H3
InChIKeyWUSQVBORMXFZSC-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.52
Rot. Bonds2

About 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine

1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine (PubChem CID 174580283) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine
PubChem CID174580283
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC Name1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine
SMILESCc1c(NC2CCN(C)CC2)cccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c1-10-12(14(15,16)17)4-3-5-13(10)18-11-6-8-19(2)9-7-11/h3-5,11,18H,6-9H2,1-2H3
InChIKeyWUSQVBORMXFZSC-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-2-methylphenyl)-1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
CID 3931119
N,2-dimethyl-3-[(1-methylpiperidin-4-yl)amino]benzamide
CID 43734523
N-[2-fluoro-5-(trifluoromethyl)phenyl]-1-methylpiperidin-4-amine
CID 55144195
1-methyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]azepan-4-amine
CID 65070364
N-[4-bromo-3-(trifluoromethyl)phenyl]-1-methylpiperidin-4-amine
CID 43680385
N-[2-chloro-4-(trifluoromethyl)phenyl]-1-methylpiperidin-4-amine
CID 43714555
1,3-dimethyl-N-[2-(trifluoromethyl)phenyl]piperidin-4-amine
CID 114504908
N-(4-tert-butylcyclohexyl)-2-(trifluoromethyl)aniline
CID 4711830
1-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)azepan-4-amine
CID 65071434
3-fluoro-1-N-(1-methylpyrrolidin-3-yl)benzene-1,2-diamine
CID 61462092
1-[[2-methyl-3-(trifluoromethyl)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122086831
N-[3-(1H-indol-3-ylsulfonyl)-2-(trifluoromethyl)phenyl]-1-methylpiperidin-4-amine
CID 53304167

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine?
The IUPAC name of 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine (CID 174580283) is 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine?
The canonical SMILES for 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine is Cc1c(NC2CCN(C)CC2)cccc1C(F)(F)F.
What is the InChIKey of 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine?
The InChIKey is WUSQVBORMXFZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-10-12(14(15,16)17)4-3-5-13(10)18-11-6-8-19(2)9-7-11/h3-5,11,18H,6-9H2,1-2H3.
What are the key properties of 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine?
1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine has a molecular weight of 272.31 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-methyl-3-(trifluoromethyl)phenyl]piperidin-4-amine is sourced from PubChem (CID 174580283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).