6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

C12H9F4N3 — CID 102716896

IUPAC6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(-c2ccncc2F)n1
InChIInChI=1S/C12H9F4N3/c1-17-11-5-7(12(14,15)16)4-10(19-11)8-2-3-18-6-9(8)13/h2-6H,1H3,(H,17,19)
InChIKeyOHQYDBXZXKERSD-UHFFFAOYSA-N
MW271.22 g/mol
LogP3.34
Rot. Bonds2

About 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102716896) has the molecular formula C12H9F4N3 and a molecular weight of 271.22 g/mol. Its IUPAC name is 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102716896
Molecular FormulaC12H9F4N3
Molecular Weight271.22 g/mol
Exact Mass271.07
IUPAC Name6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(-c2ccncc2F)n1
InChIInChI=1S/C12H9F4N3/c1-17-11-5-7(12(14,15)16)4-10(19-11)8-2-3-18-6-9(8)13/h2-6H,1H3,(H,17,19)
InChIKeyOHQYDBXZXKERSD-UHFFFAOYSA-N
XLogP3.34
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.22
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2,5-difluorophenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716671
6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716533
2-N-methyl-6-N-(pyridin-3-ylmethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717377
6-(3,4-dichlorophenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716637
N,2-dimethyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-amine
CID 102709116
6-(2-ethylpyrazol-3-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716717
4-chloro-6-(3-fluoro-4-pyridinyl)-2-methylpyrimidine
CID 104739149
N-methyl-4-(trifluoromethyl)pyridin-2-amine;hydrochloride
CID 175492104
6-(3-ethylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716831
6-imidazo[1,2-a]pyridin-5-yl-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716936
6-N-[(4-chlorophenyl)methyl]-2-N-methyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717237
N-methyl-4-(3-methyl-4-pyridinyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563377

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (CID 102716896) is 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(-c2ccncc2F)n1.
What is the InChIKey of 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is OHQYDBXZXKERSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F4N3/c1-17-11-5-7(12(14,15)16)4-10(19-11)8-2-3-18-6-9(8)13/h2-6H,1H3,(H,17,19).
What are the key properties of 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 271.22 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoro-4-pyridinyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102716896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).