6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine

C8H10F3N3O — CID 43261093

IUPAC6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
SMILESCOc1nc(NCC(F)(F)F)ccc1N
InChIInChI=1S/C8H10F3N3O/c1-15-7-5(12)2-3-6(14-7)13-4-8(9,10)11/h2-3H,4,12H2,1H3,(H,13,14)
InChIKeyWUMBRJWBUZGSPU-UHFFFAOYSA-N
MW221.18 g/mol
LogP1.65
Rot. Bonds3

About 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine

6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine (PubChem CID 43261093) has the molecular formula C8H10F3N3O and a molecular weight of 221.18 g/mol. Its IUPAC name is 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
PubChem CID43261093
Molecular FormulaC8H10F3N3O
Molecular Weight221.18 g/mol
Exact Mass221.08
IUPAC Name6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
SMILESCOc1nc(NCC(F)(F)F)ccc1N
InChIInChI=1S/C8H10F3N3O/c1-15-7-5(12)2-3-6(14-7)13-4-8(9,10)11/h2-3H,4,12H2,1H3,(H,13,14)
InChIKeyWUMBRJWBUZGSPU-UHFFFAOYSA-N
XLogP1.65
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.18
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-2-N-(2,2,3,3-tetrafluoropropyl)pyridine-2,5-diamine
CID 114169053
6-ethoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
CID 43261092
6-methoxy-2-N-(2-methylbutan-2-yl)pyridine-2,5-diamine
CID 43261292
2-[(5-amino-6-methoxy-2-pyridinyl)amino]-2-methylpropan-1-ol
CID 43498830
2-[(5-amino-6-methoxy-2-pyridinyl)amino]acetamide
CID 43260954
2-N-benzyl-6-methoxypyridine-2,5-diamine
CID 43261004
3-[(5-amino-6-methoxy-2-pyridinyl)amino]-2,3-dimethylbutan-2-ol
CID 114155171
6-[(2-methylpropan-2-yl)oxy]-2-N-(2,2,3,3-tetrafluoropropyl)pyridine-2,5-diamine
CID 106289927
3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-2,2-difluoropropan-1-ol
CID 106167469
6-methoxy-2-N-[(1-methylcyclopentyl)methyl]pyridine-2,5-diamine
CID 55259668
2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 103460190
2-N-(2-methoxy-2-methylpropyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 113449896

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine?
The IUPAC name of 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine (CID 43261093) is 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine.
What is the SMILES notation for 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine?
The canonical SMILES for 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine is COc1nc(NCC(F)(F)F)ccc1N.
What is the InChIKey of 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine?
The InChIKey is WUMBRJWBUZGSPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3O/c1-15-7-5(12)2-3-6(14-7)13-4-8(9,10)11/h2-3H,4,12H2,1H3,(H,13,14).
What are the key properties of 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine?
6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine has a molecular weight of 221.18 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine is sourced from PubChem (CID 43261093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).