N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine

C14H19F3N2 — CID 63297008

IUPACN-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine
SMILESCC(c1cccc(C(F)(F)F)c1)N(C)C1CCNC1
InChIInChI=1S/C14H19F3N2/c1-10(19(2)13-6-7-18-9-13)11-4-3-5-12(8-11)14(15,16)17/h3-5,8,10,13,18H,6-7,9H2,1-2H3
InChIKeyBLDHXGMIJNCCTG-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.06
Rot. Bonds3

About N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine

N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine (PubChem CID 63297008) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine
PubChem CID63297008
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC NameN-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine
SMILESCC(c1cccc(C(F)(F)F)c1)N(C)C1CCNC1
InChIInChI=1S/C14H19F3N2/c1-10(19(2)13-6-7-18-9-13)11-4-3-5-12(8-11)14(15,16)17/h3-5,8,10,13,18H,6-7,9H2,1-2H3
InChIKeyBLDHXGMIJNCCTG-UHFFFAOYSA-N
XLogP3.06
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 ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-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

N-ethyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]azetidin-3-amine
CID 66183131
N-methyl-N-pyrrolidin-3-yl-3-[3-(trifluoromethyl)phenyl]butanamide;hydrochloride
CID 119550376
N-methyl-N-[1-(4-phenylphenyl)ethyl]pyrrolidin-3-amine
CID 63297346
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N-methylpyrrolidin-3-amine
CID 63297147
N-ethyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxamide
CID 119329896
N-cyclopropyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]piperidine-4-carboxamide;hydrochloride
CID 119297142
N-[1-(2,3-difluorophenyl)ethyl]-N-methylpyrrolidin-3-amine
CID 114059322
3-[1-[3-(trifluoromethyl)phenyl]ethoxy]azetidine
CID 172798523
N-[1-(3-bromophenyl)ethyl]-N-methylazepan-4-amine
CID 107172110
N-[1-(3-chlorophenyl)ethyl]-N-methylazetidin-3-amine
CID 62979516
piperidin-4-yl-[3-(trifluoromethyl)phenyl]methanol
CID 11392289
N-[1-(2,3-dichlorophenyl)ethyl]-N-methylpyrrolidin-3-amine
CID 114079689

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine?
The IUPAC name of N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine (CID 63297008) is N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine.
What is the SMILES notation for N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine?
The canonical SMILES for N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine is CC(c1cccc(C(F)(F)F)c1)N(C)C1CCNC1.
What is the InChIKey of N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine?
The InChIKey is BLDHXGMIJNCCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-10(19(2)13-6-7-18-9-13)11-4-3-5-12(8-11)14(15,16)17/h3-5,8,10,13,18H,6-7,9H2,1-2H3.
What are the key properties of N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine?
N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine has a molecular weight of 272.31 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyrrolidin-3-amine is sourced from PubChem (CID 63297008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).