6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine

C11H15F2N3O — CID 114074158

IUPAC6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine
SMILESCC1(C)CN(c2nc(N)c(F)cc2F)CCO1
InChIInChI=1S/C11H15F2N3O/c1-11(2)6-16(3-4-17-11)10-8(13)5-7(12)9(14)15-10/h5H,3-4,6H2,1-2H3,(H2,14,15)
InChIKeySMJBEXOHCDJHAJ-UHFFFAOYSA-N
MW243.26 g/mol
LogP1.56
Rot. Bonds1

About 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine

6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine (PubChem CID 114074158) has the molecular formula C11H15F2N3O and a molecular weight of 243.26 g/mol. Its IUPAC name is 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine.

Molecular Properties

Compound Name6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine
PubChem CID114074158
Molecular FormulaC11H15F2N3O
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Name6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine
SMILESCC1(C)CN(c2nc(N)c(F)cc2F)CCO1
InChIInChI=1S/C11H15F2N3O/c1-11(2)6-16(3-4-17-11)10-8(13)5-7(12)9(14)15-10/h5H,3-4,6H2,1-2H3,(H2,14,15)
InChIKeySMJBEXOHCDJHAJ-UHFFFAOYSA-N
XLogP1.56
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine?
The IUPAC name of 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine (CID 114074158) is 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine.
What is the SMILES notation for 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine?
The canonical SMILES for 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine is CC1(C)CN(c2nc(N)c(F)cc2F)CCO1.
What is the InChIKey of 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine?
The InChIKey is SMJBEXOHCDJHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2N3O/c1-11(2)6-16(3-4-17-11)10-8(13)5-7(12)9(14)15-10/h5H,3-4,6H2,1-2H3,(H2,14,15).
What are the key properties of 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine?
6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine has a molecular weight of 243.26 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethylmorpholin-4-yl)-3,5-difluoropyridin-2-amine is sourced from PubChem (CID 114074158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).