6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine

C14H12BrF3N2 — CID 102716853

IUPAC6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCNc1cc(C(F)(F)F)cc(-c2cccc(Br)c2)n1
InChIInChI=1S/C14H12BrF3N2/c1-2-19-13-8-10(14(16,17)18)7-12(20-13)9-4-3-5-11(15)6-9/h3-8H,2H2,1H3,(H,19,20)
InChIKeyPAXVXEFZJYGAPZ-UHFFFAOYSA-N
MW345.16 g/mol
LogP4.96
Rot. Bonds3

About 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine

6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102716853) has the molecular formula C14H12BrF3N2 and a molecular weight of 345.16 g/mol. Its IUPAC name is 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102716853
Molecular FormulaC14H12BrF3N2
Molecular Weight345.16 g/mol
Exact Mass344.01
IUPAC Name6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCNc1cc(C(F)(F)F)cc(-c2cccc(Br)c2)n1
InChIInChI=1S/C14H12BrF3N2/c1-2-19-13-8-10(14(16,17)18)7-12(20-13)9-4-3-5-11(15)6-9/h3-8H,2H2,1H3,(H,19,20)
InChIKeyPAXVXEFZJYGAPZ-UHFFFAOYSA-N
XLogP4.96
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.16
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(3,4-dimethylphenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716647
6-(3-bromophenyl)-N-ethyl-2-methylpyrimidin-4-amine
CID 115504032
6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716586
6-(3-bromophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716854
6-(2,3-dimethylphenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716650
N-ethyl-6-(2-methylphenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716549
N-ethyl-6-(5-methyl-3-pyridinyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716835
6-(3-ethylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716831
5-(3-bromophenyl)-N-ethyl-1H-pyrazol-3-amine
CID 63047953
N-ethyl-6-[3-(trifluoromethyl)phenyl]pyridazin-3-amine
CID 62201435
2-(3-bromophenyl)-6-methyl-4-[4-(trifluoromethyl)phenyl]pyridine
CID 57468745
2,6-bis(3-methylphenyl)-4-(trifluoromethyl)pyridine
CID 163288516

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine (CID 102716853) is 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine is CCNc1cc(C(F)(F)F)cc(-c2cccc(Br)c2)n1.
What is the InChIKey of 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is PAXVXEFZJYGAPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrF3N2/c1-2-19-13-8-10(14(16,17)18)7-12(20-13)9-4-3-5-11(15)6-9/h3-8H,2H2,1H3,(H,19,20).
What are the key properties of 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 345.16 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromophenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102716853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).