3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine

C8H7F5N2O2 — CID 118800001

IUPAC3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
SMILESCOc1cnc(OC(F)(F)F)c(C(F)F)c1N
InChIInChI=1S/C8H7F5N2O2/c1-16-3-2-15-7(17-8(11,12)13)4(5(3)14)6(9)10/h2,6H,1H3,(H2,14,15)
InChIKeyALVQPUQFTLJNOV-UHFFFAOYSA-N
MW258.15 g/mol
LogP2.51
Rot. Bonds3

About 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine

3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine (PubChem CID 118800001) has the molecular formula C8H7F5N2O2 and a molecular weight of 258.15 g/mol. Its IUPAC name is 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine.

Molecular Properties

Compound Name3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
PubChem CID118800001
Molecular FormulaC8H7F5N2O2
Molecular Weight258.15 g/mol
Exact Mass258.04
IUPAC Name3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
SMILESCOc1cnc(OC(F)(F)F)c(C(F)F)c1N
InChIInChI=1S/C8H7F5N2O2/c1-16-3-2-15-7(17-8(11,12)13)4(5(3)14)6(9)10/h2,6H,1H3,(H2,14,15)
InChIKeyALVQPUQFTLJNOV-UHFFFAOYSA-N
XLogP2.51
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.15
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(difluoromethyl)-2,5-dimethoxypyridin-4-amine
CID 130100785
4-(difluoromethyl)-5-methoxy-3-methyl-2-(trifluoromethoxy)pyridine
CID 134660494
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridine-4-carbaldehyde
CID 134677184
5-bromo-3-(difluoromethyl)-2-(trifluoromethoxy)pyridin-4-amine
CID 118822184
3-(difluoromethyl)-5-methoxypyridine-2,4-diamine
CID 119019295
3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine
CID 119021668
[4-(difluoromethyl)-5-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 118825721
2-chloro-3-(difluoromethyl)-5-(trifluoromethoxy)pyridin-4-amine
CID 118811897
4-amino-3-(difluoromethyl)-5-methoxypyridine-2-carbonyl chloride
CID 118812031
[4-amino-3-(difluoromethyl)-5-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118851542
4-(difluoromethyl)-2-fluoro-5-methoxy-3-(trifluoromethoxy)pyridine
CID 118812562
[4-(difluoromethyl)-5-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118824029

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine?
The IUPAC name of 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine (CID 118800001) is 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine.
What is the SMILES notation for 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine?
The canonical SMILES for 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine is COc1cnc(OC(F)(F)F)c(C(F)F)c1N.
What is the InChIKey of 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine?
The InChIKey is ALVQPUQFTLJNOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F5N2O2/c1-16-3-2-15-7(17-8(11,12)13)4(5(3)14)6(9)10/h2,6H,1H3,(H2,14,15).
What are the key properties of 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine?
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine has a molecular weight of 258.15 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine is sourced from PubChem (CID 118800001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).