[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine

C9H11F3N2O2 — CID 134670225

IUPAC[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine
SMILESCOc1cc(CN)nc(C)c1OC(F)(F)F
InChIInChI=1S/C9H11F3N2O2/c1-5-8(16-9(10,11)12)7(15-2)3-6(4-13)14-5/h3H,4,13H2,1-2H3
InChIKeyLNOXFAGIRIUVTI-UHFFFAOYSA-N
MW236.19 g/mol
LogP1.76
Rot. Bonds3

About [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine

[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine (PubChem CID 134670225) has the molecular formula C9H11F3N2O2 and a molecular weight of 236.19 g/mol. Its IUPAC name is [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine
PubChem CID134670225
Molecular FormulaC9H11F3N2O2
Molecular Weight236.19 g/mol
Exact Mass236.08
IUPAC Name[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine
SMILESCOc1cc(CN)nc(C)c1OC(F)(F)F
InChIInChI=1S/C9H11F3N2O2/c1-5-8(16-9(10,11)12)7(15-2)3-6(4-13)14-5/h3H,4,13H2,1-2H3
InChIKeyLNOXFAGIRIUVTI-UHFFFAOYSA-N
XLogP1.76
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.19
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134663138
[5-methoxy-4-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 118837036
[6-(aminomethyl)-3-methoxy-4-(trifluoromethoxy)-2-pyridinyl]methanol
CID 134666113
4-methoxy-2-methyl-6-nitro-3-(trifluoromethoxy)pyridine
CID 134668132
methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134679723
ethyl 2-[5-methoxy-6-methyl-4-(trifluoromethoxy)-2-pyridinyl]acetate
CID 134660565
ethyl 2-[6-(aminomethyl)-2-iodo-3-(trifluoromethoxy)-4-pyridinyl]acetate
CID 134668835
2-iodo-4-methoxy-6-methyl-3-(trifluoromethoxy)pyridine
CID 130112544
2-[4-methoxy-5-(trifluoromethoxy)-6-(trifluoromethyl)-2-pyridinyl]acetonitrile
CID 134682248
[4,6-dichloro-5-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 130093865
[5,6-difluoro-4-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 130094281
2-(aminomethyl)-4-methoxy-6-(trifluoromethoxy)pyridin-3-amine
CID 133086231

Frequently Asked Questions

What is the IUPAC name of [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine?
The IUPAC name of [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine (CID 134670225) is [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine is COc1cc(CN)nc(C)c1OC(F)(F)F.
What is the InChIKey of [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine?
The InChIKey is LNOXFAGIRIUVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2O2/c1-5-8(16-9(10,11)12)7(15-2)3-6(4-13)14-5/h3H,4,13H2,1-2H3.
What are the key properties of [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine?
[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine has a molecular weight of 236.19 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 134670225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).