3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine

C8H10F3N3O2 — CID 118990870

IUPAC3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine
SMILESCOc1cc(CN)c(N)nc1OC(F)(F)F
InChIInChI=1S/C8H10F3N3O2/c1-15-5-2-4(3-12)6(13)14-7(5)16-8(9,10)11/h2H,3,12H2,1H3,(H2,13,14)
InChIKeyBBPLIGSMCLLFSF-UHFFFAOYSA-N
MW237.18 g/mol
LogP1.03
Rot. Bonds3

About 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine

3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine (PubChem CID 118990870) has the molecular formula C8H10F3N3O2 and a molecular weight of 237.18 g/mol. Its IUPAC name is 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine
PubChem CID118990870
Molecular FormulaC8H10F3N3O2
Molecular Weight237.18 g/mol
Exact Mass237.07
IUPAC Name3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine
SMILESCOc1cc(CN)c(N)nc1OC(F)(F)F
InChIInChI=1S/C8H10F3N3O2/c1-15-5-2-4(3-12)6(13)14-7(5)16-8(9,10)11/h2H,3,12H2,1H3,(H2,13,14)
InChIKeyBBPLIGSMCLLFSF-UHFFFAOYSA-N
XLogP1.03
TPSA83.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.18
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(aminomethyl)-6-(difluoromethyl)-5-(trifluoromethoxy)pyridin-2-amine
CID 119005302
2-[5-(aminomethyl)-3-methoxy-6-(trifluoromethoxy)-2-pyridinyl]acetonitrile
CID 134666110
[2-iodo-6-methoxy-5-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 134666898
methyl 2-[5-(aminomethyl)-3-methoxy-6-(trifluoromethoxy)-2-pyridinyl]acetate
CID 134665618
[5-(aminomethyl)-2-methoxy-6-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134680161
2-(aminomethyl)-4-methoxy-6-(trifluoromethoxy)pyridin-3-amine
CID 133086231
methyl 3-(aminomethyl)-6-methoxy-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134668833
5-(aminomethyl)-6-fluoro-2-(trifluoromethoxy)pyridin-3-amine
CID 133086177
[3,6-dimethyl-2-(trifluoromethoxy)-4-pyridinyl]methanamine
CID 131527479
2-[5-(aminomethyl)-6-methoxy-2-(trifluoromethoxy)-3-pyridinyl]acetonitrile
CID 134670121
[4-(aminomethyl)-6-methoxy-2-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134681809
3-(aminomethyl)-6-methoxy-4-(trifluoromethoxy)pyridin-2-amine
CID 133086223

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine (CID 118990870) is 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine is COc1cc(CN)c(N)nc1OC(F)(F)F.
What is the InChIKey of 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine?
The InChIKey is BBPLIGSMCLLFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3O2/c1-15-5-2-4(3-12)6(13)14-7(5)16-8(9,10)11/h2H,3,12H2,1H3,(H2,13,14).
What are the key properties of 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine?
3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine has a molecular weight of 237.18 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 118990870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).