3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine

C13H21N3O — CID 102742872

IUPAC3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine
SMILESCC1(C)CN(c2cccnc2N)CC(C)(C)O1
InChIInChI=1S/C13H21N3O/c1-12(2)8-16(9-13(3,4)17-12)10-6-5-7-15-11(10)14/h5-7H,8-9H2,1-4H3,(H2,14,15)
InChIKeyQPYBBCXCCUSPBY-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.06
Rot. Bonds1

About 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine

3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine (PubChem CID 102742872) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine
PubChem CID102742872
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine
SMILESCC1(C)CN(c2cccnc2N)CC(C)(C)O1
InChIInChI=1S/C13H21N3O/c1-12(2)8-16(9-13(3,4)17-12)10-6-5-7-15-11(10)14/h5-7H,8-9H2,1-4H3,(H2,14,15)
InChIKeyQPYBBCXCCUSPBY-UHFFFAOYSA-N
XLogP2.06
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine?
The IUPAC name of 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine (CID 102742872) is 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine.
What is the SMILES notation for 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine?
The canonical SMILES for 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine is CC1(C)CN(c2cccnc2N)CC(C)(C)O1.
What is the InChIKey of 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine?
The InChIKey is QPYBBCXCCUSPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-12(2)8-16(9-13(3,4)17-12)10-6-5-7-15-11(10)14/h5-7H,8-9H2,1-4H3,(H2,14,15).
What are the key properties of 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine?
3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,6,6-tetramethylmorpholin-4-yl)pyridin-2-amine is sourced from PubChem (CID 102742872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).