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

C14H19F3N2 — CID 63642278

IUPACN-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
SMILESCN(Cc1cccc(C(F)(F)F)c1)C1CCCNC1
InChIInChI=1S/C14H19F3N2/c1-19(13-6-3-7-18-9-13)10-11-4-2-5-12(8-11)14(15,16)17/h2,4-5,8,13,18H,3,6-7,9-10H2,1H3
InChIKeyHHNAPDJHNZEXCP-UHFFFAOYSA-N
MW272.31 g/mol
LogP2.89
Rot. Bonds3

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

N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine (PubChem CID 63642278) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
PubChem CID63642278
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC NameN-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
SMILESCN(Cc1cccc(C(F)(F)F)c1)C1CCCNC1
InChIInChI=1S/C14H19F3N2/c1-19(13-6-3-7-18-9-13)10-11-4-2-5-12(8-11)14(15,16)17/h2,4-5,8,13,18H,3,6-7,9-10H2,1H3
InChIKeyHHNAPDJHNZEXCP-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-piperidin-3-yl-N-[[3-(trifluoromethyl)phenyl]methyl]methanamine;hydrochloride
CID 119930674
3-[[methyl(piperidin-3-yl)amino]methyl]phenol
CID 63644225
N-methyl-4-[(3S)-piperidin-3-yl]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
CID 97202795
N-[(4-fluoro-3-methylphenyl)methyl]-N-methylpiperidin-3-amine
CID 63643681
N-[(2,6-difluorophenyl)methyl]-N-methylpiperidin-3-amine
CID 55248730
N-methyl-N-pyrrolidin-3-yl-2-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119553639
N-[(3-bromophenyl)methyl]-N-methylpyrrolidin-3-amine
CID 62327410
N-[(3-chloro-4-methylphenyl)methyl]-N-methylpiperidin-3-amine
CID 106817825
N-[(3-cyclopropylphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 79984146
N-benzyl-N-methylpyrrolidin-3-amine
CID 14834678
(3R)-N-[(2-bromo-4-pyridinyl)methyl]-N-methylpiperidin-3-amine;hydrochloride
CID 71641627
N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]hydroxylamine
CID 105456998

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
The IUPAC name of N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine (CID 63642278) is N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine.
What is the SMILES notation for N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
The canonical SMILES for N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine is CN(Cc1cccc(C(F)(F)F)c1)C1CCCNC1.
What is the InChIKey of N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
The InChIKey is HHNAPDJHNZEXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-19(13-6-3-7-18-9-13)10-11-4-2-5-12(8-11)14(15,16)17/h2,4-5,8,13,18H,3,6-7,9-10H2,1H3.
What are the key properties of N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine?
N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine has a molecular weight of 272.31 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine is sourced from PubChem (CID 63642278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).