6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine

C15H14F4N2 — CID 102716586

IUPAC6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCNc1cc(C(F)(F)F)cc(-c2cccc(F)c2)n1
InChIInChI=1S/C15H14F4N2/c1-2-6-20-14-9-11(15(17,18)19)8-13(21-14)10-4-3-5-12(16)7-10/h3-5,7-9H,2,6H2,1H3,(H,20,21)
InChIKeyIBIWBDRSIBQZOR-UHFFFAOYSA-N
MW298.28 g/mol
LogP4.73
Rot. Bonds4

About 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine

6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102716586) has the molecular formula C15H14F4N2 and a molecular weight of 298.28 g/mol. Its IUPAC name is 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102716586
Molecular FormulaC15H14F4N2
Molecular Weight298.28 g/mol
Exact Mass298.11
IUPAC Name6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCNc1cc(C(F)(F)F)cc(-c2cccc(F)c2)n1
InChIInChI=1S/C15H14F4N2/c1-2-6-20-14-9-11(15(17,18)19)8-13(21-14)10-4-3-5-12(16)7-10/h3-5,7-9H,2,6H2,1H3,(H,20,21)
InChIKeyIBIWBDRSIBQZOR-UHFFFAOYSA-N
XLogP4.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716707
6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716853
6-(1-methylpyrazol-4-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716615
6-(3,4-dimethylphenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716647
N-ethyl-6-(3-fluorophenyl)-2-propylpyrimidin-4-amine
CID 80945378
6-phenyl-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769168
6-(3-ethylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716831
6-(2-ethylpyrazol-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716720
6-(2-methylthiophen-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102838356
N,2-diethyl-6-(3-fluorophenyl)pyrimidin-4-amine
CID 80936579
2-N-propyl-6-N-(2,2,2-trifluoroethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717325
6-(3-fluorophenyl)-5-methyl-N-propylpyridazin-3-amine
CID 114872900

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine (CID 102716586) is 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine is CCCNc1cc(C(F)(F)F)cc(-c2cccc(F)c2)n1.
What is the InChIKey of 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is IBIWBDRSIBQZOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F4N2/c1-2-6-20-14-9-11(15(17,18)19)8-13(21-14)10-4-3-5-12(16)7-10/h3-5,7-9H,2,6H2,1H3,(H,20,21).
What are the key properties of 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 298.28 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102716586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).