2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine

C13H11F3N2 — CID 174629895

IUPAC2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine
SMILESCc1ncc(C(F)(F)F)c(-c2ccccc2)c1N
InChIInChI=1S/C13H11F3N2/c1-8-12(17)11(9-5-3-2-4-6-9)10(7-18-8)13(14,15)16/h2-7H,17H2,1H3
InChIKeyFBWHRFBBAKBDDS-UHFFFAOYSA-N
MW252.24 g/mol
LogP3.66
Rot. Bonds1

About 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine

2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine (PubChem CID 174629895) has the molecular formula C13H11F3N2 and a molecular weight of 252.24 g/mol. Its IUPAC name is 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine
PubChem CID174629895
Molecular FormulaC13H11F3N2
Molecular Weight252.24 g/mol
Exact Mass252.09
IUPAC Name2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine
SMILESCc1ncc(C(F)(F)F)c(-c2ccccc2)c1N
InChIInChI=1S/C13H11F3N2/c1-8-12(17)11(9-5-3-2-4-6-9)10(7-18-8)13(14,15)16/h2-7H,17H2,1H3
InChIKeyFBWHRFBBAKBDDS-UHFFFAOYSA-N
XLogP3.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.24
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-N,2-dimethyl-5-(trifluoromethyl)pyridine-3,4-diamine
CID 172738194
2,4,6-triphenyl-5-(trifluoromethyl)benzene-1,3-diamine
CID 170390398
2,3-dimethyl-5-[2-(trifluoromethyl)phenyl]pyridine
CID 145031967
3-(bromomethyl)-4-phenyl-5-(trifluoromethyl)pyridine
CID 133098043
2-methyl-4-phenyl-5-(trifluoromethyl)quinolin-3-ol
CID 122604521
4-(2-methylphenyl)-5-(trifluoromethyl)pyridin-2-amine
CID 153325933
2-methylsulfanyl-4-phenyl-5-(trifluoromethyl)pyrimidine
CID 71232496
2,4,6-triphenylbenzene-1,3,5-triamine
CID 22926582
4-phenyl-2-(1H-pyrrol-2-yl)-5-(trifluoromethyl)pyridine-3-carboxamide
CID 175244120
4-methyl-8-(trifluoromethyl)quinolin-3-amine
CID 105483666
4-chloro-6-methyl-5-phenyl-2-(trifluoromethyl)pyrimidine
CID 58089417
2-fluoro-5-phenyl-3-(trifluoromethyl)pyridine
CID 133094917

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine (CID 174629895) is 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine is Cc1ncc(C(F)(F)F)c(-c2ccccc2)c1N.
What is the InChIKey of 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine?
The InChIKey is FBWHRFBBAKBDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N2/c1-8-12(17)11(9-5-3-2-4-6-9)10(7-18-8)13(14,15)16/h2-7H,17H2,1H3.
What are the key properties of 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine?
2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine has a molecular weight of 252.24 g/mol, XLogP of 3.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-phenyl-5-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 174629895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).