6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine

C12H16F3N3O — CID 115320894

IUPAC6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine
SMILESCOc1ccc(N)c(N2CCCC(C(F)(F)F)C2)n1
InChIInChI=1S/C12H16F3N3O/c1-19-10-5-4-9(16)11(17-10)18-6-2-3-8(7-18)12(13,14)15/h4-5,8H,2-3,6-7,16H2,1H3
InChIKeyUBVICTBYYNGJAN-UHFFFAOYSA-N
MW275.27 g/mol
LogP2.45
Rot. Bonds2

About 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine

6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine (PubChem CID 115320894) has the molecular formula C12H16F3N3O and a molecular weight of 275.27 g/mol. Its IUPAC name is 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine
PubChem CID115320894
Molecular FormulaC12H16F3N3O
Molecular Weight275.27 g/mol
Exact Mass275.12
IUPAC Name6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine
SMILESCOc1ccc(N)c(N2CCCC(C(F)(F)F)C2)n1
InChIInChI=1S/C12H16F3N3O/c1-19-10-5-4-9(16)11(17-10)18-6-2-3-8(7-18)12(13,14)15/h4-5,8H,2-3,6-7,16H2,1H3
InChIKeyUBVICTBYYNGJAN-UHFFFAOYSA-N
XLogP2.45
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 5-amino-6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2-carboxylate
CID 114406868
4-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyrimidine
CID 126817206
6-methoxy-2-(4-propan-2-ylazepan-1-yl)pyridin-3-amine
CID 115320844
6-methoxy-2-(4-methylsulfanylazepan-1-yl)pyridin-3-amine
CID 114236704
1-(3-amino-6-methoxy-2-pyridinyl)pyrrolidine-3,4-diol
CID 106667349
6-[3-(trifluoromethyl)piperidin-1-yl]pyridine-2,3-diamine
CID 79825633
2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine
CID 114196245
2-(4-tert-butylpiperazin-1-yl)-6-methoxypyridin-3-amine
CID 115320517
1-(3-amino-6-methoxy-2-pyridinyl)-4-methylpiperidin-4-ol
CID 115320981
6-methoxy-2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyridin-3-amine
CID 115320947
4-[(3S)-3-(trifluoromethyl)piperidin-1-yl]aniline
CID 97044380
5-phenyl-6-[3-(trifluoromethyl)piperidin-1-yl]-1,2,4-triazin-3-amine
CID 53353230

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine?
The IUPAC name of 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine (CID 115320894) is 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine.
What is the SMILES notation for 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine?
The canonical SMILES for 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine is COc1ccc(N)c(N2CCCC(C(F)(F)F)C2)n1.
What is the InChIKey of 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine?
The InChIKey is UBVICTBYYNGJAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F3N3O/c1-19-10-5-4-9(16)11(17-10)18-6-2-3-8(7-18)12(13,14)15/h4-5,8H,2-3,6-7,16H2,1H3.
What are the key properties of 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine?
6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine has a molecular weight of 275.27 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine is sourced from PubChem (CID 115320894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).