6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine

C11H15F2N3O — CID 146200687

IUPAC6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine
SMILESCOc1nc(N2CCC(F)(F)CC2)ccc1N
InChIInChI=1S/C11H15F2N3O/c1-17-10-8(14)2-3-9(15-10)16-6-4-11(12,13)5-7-16/h2-3H,4-7,14H2,1H3
InChIKeyKWKQZWQDOBBNHH-UHFFFAOYSA-N
MW243.26 g/mol
LogP1.91
Rot. Bonds2

About 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine

6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine (PubChem CID 146200687) has the molecular formula C11H15F2N3O and a molecular weight of 243.26 g/mol. Its IUPAC name is 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine.

Molecular Properties

Compound Name6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine
PubChem CID146200687
Molecular FormulaC11H15F2N3O
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Name6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine
SMILESCOc1nc(N2CCC(F)(F)CC2)ccc1N
InChIInChI=1S/C11H15F2N3O/c1-17-10-8(14)2-3-9(15-10)16-6-4-11(12,13)5-7-16/h2-3H,4-7,14H2,1H3
InChIKeyKWKQZWQDOBBNHH-UHFFFAOYSA-N
XLogP1.91
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine?
The IUPAC name of 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine (CID 146200687) is 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine.
What is the SMILES notation for 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine?
The canonical SMILES for 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine is COc1nc(N2CCC(F)(F)CC2)ccc1N.
What is the InChIKey of 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine?
The InChIKey is KWKQZWQDOBBNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2N3O/c1-17-10-8(14)2-3-9(15-10)16-6-4-11(12,13)5-7-16/h2-3H,4-7,14H2,1H3.
What are the key properties of 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine?
6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine has a molecular weight of 243.26 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,4-difluoropiperidin-1-yl)-2-methoxypyridin-3-amine is sourced from PubChem (CID 146200687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).