2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine

C8H10F2N2O — CID 174718248

IUPAC2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine
SMILESCOc1cnc(C(C)(F)F)cc1N
InChIInChI=1S/C8H10F2N2O/c1-8(9,10)7-3-5(11)6(13-2)4-12-7/h3-4H,1-2H3,(H2,11,12)
InChIKeyMWDJLOFKWUDRIW-UHFFFAOYSA-N
MW188.18 g/mol
LogP1.78
Rot. Bonds2

About 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine

2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine (PubChem CID 174718248) has the molecular formula C8H10F2N2O and a molecular weight of 188.18 g/mol. Its IUPAC name is 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine.

Molecular Properties

Compound Name2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine
PubChem CID174718248
Molecular FormulaC8H10F2N2O
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine
SMILESCOc1cnc(C(C)(F)F)cc1N
InChIInChI=1S/C8H10F2N2O/c1-8(9,10)7-3-5(11)6(13-2)4-12-7/h3-4H,1-2H3,(H2,11,12)
InChIKeyMWDJLOFKWUDRIW-UHFFFAOYSA-N
XLogP1.78
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1,1-difluoroethyl)pyridine-3,4-diamine
CID 142460928
5-methoxy-2-methylpyridin-4-amine
CID 59938080
4-methoxy-6-(trifluoromethoxy)pyridin-3-amine
CID 130089066
1-[5-methoxy-2-(trifluoromethyl)-4-pyridinyl]ethanamine;hydrochloride
CID 138505355
6-(1,1-difluoroethyl)pyridin-3-amine
CID 84716660
[4-methoxy-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 130116089
4-ethenyl-5-methoxy-2-(trifluoromethyl)pyridine
CID 130679623
N-(4-amino-5-methoxy-2-pyridinyl)acetamide
CID 170730714
5-iodo-4-methoxy-2-(trifluoromethyl)pyridine
CID 121228606
2-tert-butyl-5-fluoropyridin-4-amine
CID 155709241
2-methoxy-5-(trifluoromethyl)benzene-1,4-diamine
CID 162535431
4-N-(2-methoxyphenyl)-4-N-methyl-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106747617

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine?
The IUPAC name of 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine (CID 174718248) is 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine.
What is the SMILES notation for 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine?
The canonical SMILES for 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine is COc1cnc(C(C)(F)F)cc1N.
What is the InChIKey of 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine?
The InChIKey is MWDJLOFKWUDRIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O/c1-8(9,10)7-3-5(11)6(13-2)4-12-7/h3-4H,1-2H3,(H2,11,12).
What are the key properties of 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine?
2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine has a molecular weight of 188.18 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethyl)-5-methoxypyridin-4-amine is sourced from PubChem (CID 174718248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).