1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine

C14H13F3N2 — CID 18778355

IUPAC1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
SMILESFC(F)(F)c1ccccc1CNCc1cccnc1
InChIInChI=1S/C14H13F3N2/c15-14(16,17)13-6-2-1-5-12(13)10-19-9-11-4-3-7-18-8-11/h1-8,19H,9-10H2
InChIKeyULEGENZSVCKOMQ-UHFFFAOYSA-N
MW266.27 g/mol
LogP3.39
Rot. Bonds4

About 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine

1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine (PubChem CID 18778355) has the molecular formula C14H13F3N2 and a molecular weight of 266.27 g/mol. Its IUPAC name is 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine.

Molecular Properties

Compound Name1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
PubChem CID18778355
Molecular FormulaC14H13F3N2
Molecular Weight266.27 g/mol
Exact Mass266.10
IUPAC Name1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
SMILESFC(F)(F)c1ccccc1CNCc1cccnc1
InChIInChI=1S/C14H13F3N2/c15-14(16,17)13-6-2-1-5-12(13)10-19-9-11-4-3-7-18-8-11/h1-8,19H,9-10H2
InChIKeyULEGENZSVCKOMQ-UHFFFAOYSA-N
XLogP3.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-bromo-3-pyridinyl)methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 104796903
N-[(2-chlorophenyl)methyl]-1-pyridin-3-ylmethanamine;hydrochloride
CID 154879239
N-(1H-pyrazol-4-ylmethyl)-1-[2-(trifluoromethyl)phenyl]methanamine
CID 54897524
1-(4-fluorophenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
CID 834369
N-(pyridin-3-ylmethyl)-3-(trifluoromethyl)pyridin-2-amine
CID 29039345
N-[(3,5-dimethylphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 62048755
1-(4-methylphenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine;hydrochloride
CID 17332531
N-[(3,5-dichlorophenyl)methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 62048756
1-(furan-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
CID 60980661
N-tert-butyl-2-[(pyridin-3-ylmethylamino)methyl]benzenesulfonamide
CID 48563030
1-pyridin-4-yl-N-(pyridin-3-ylmethyl)methanamine;dihydrochloride
CID 163329891
1-(1,2-oxazol-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine
CID 79494954

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine?
The IUPAC name of 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine (CID 18778355) is 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine.
What is the SMILES notation for 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine?
The canonical SMILES for 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine is FC(F)(F)c1ccccc1CNCc1cccnc1.
What is the InChIKey of 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine?
The InChIKey is ULEGENZSVCKOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2/c15-14(16,17)13-6-2-1-5-12(13)10-19-9-11-4-3-7-18-8-11/h1-8,19H,9-10H2.
What are the key properties of 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine?
1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine has a molecular weight of 266.27 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-yl-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine is sourced from PubChem (CID 18778355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).