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

C8H7F5N2O2 — CID 119021668

IUPAC3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine
SMILESCOc1c(OC(F)(F)F)cnc(N)c1C(F)F
InChIInChI=1S/C8H7F5N2O2/c1-16-5-3(17-8(11,12)13)2-15-7(14)4(5)6(9)10/h2,6H,1H3,(H2,14,15)
InChIKeyOPXKBEWHPMWZPA-UHFFFAOYSA-N
MW258.15 g/mol
LogP2.51
Rot. Bonds3

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

3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine (PubChem CID 119021668) has the molecular formula C8H7F5N2O2 and a molecular weight of 258.15 g/mol. Its IUPAC name is 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine
PubChem CID119021668
Molecular FormulaC8H7F5N2O2
Molecular Weight258.15 g/mol
Exact Mass258.04
IUPAC Name3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine
SMILESCOc1c(OC(F)(F)F)cnc(N)c1C(F)F
InChIInChI=1S/C8H7F5N2O2/c1-16-5-3(17-8(11,12)13)2-15-7(14)4(5)6(9)10/h2,6H,1H3,(H2,14,15)
InChIKeyOPXKBEWHPMWZPA-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)-4-methoxy-5-(trifluoromethyl)pyridin-2-amine
CID 119010486
4-(chloromethyl)-3-(difluoromethyl)-5-(trifluoromethoxy)pyridin-2-amine
CID 119015246
3-(difluoromethyl)-5-methoxypyridine-2,4-diamine
CID 119019295
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
CID 118800001
5-(chloromethyl)-3-(difluoromethyl)-4-(trifluoromethoxy)pyridin-2-amine
CID 119007700
4-(difluoromethyl)-2-fluoro-5-methoxy-3-(trifluoromethoxy)pyridine
CID 118812562
[3-(difluoromethyl)-4-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 118853765
[4-(difluoromethyl)-5-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 118825721
4-(difluoromethyl)-3-fluoro-5-methoxypyridin-2-amine
CID 118991384
2-chloro-3-(difluoromethyl)-5-(trifluoromethoxy)pyridin-4-amine
CID 118811897
6-amino-4-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 119014102
[4-amino-3-(difluoromethyl)-5-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118851542

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine?
The IUPAC name of 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine (CID 119021668) is 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine.
What is the SMILES notation for 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine?
The canonical SMILES for 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine is COc1c(OC(F)(F)F)cnc(N)c1C(F)F.
What is the InChIKey of 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine?
The InChIKey is OPXKBEWHPMWZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F5N2O2/c1-16-5-3(17-8(11,12)13)2-15-7(14)4(5)6(9)10/h2,6H,1H3,(H2,14,15).
What are the key properties of 3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine?
3-(difluoromethyl)-4-methoxy-5-(trifluoromethoxy)pyridin-2-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)-4-methoxy-5-(trifluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 119021668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).