2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine

C17H27N3O — CID 2912309

IUPAC2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine
SMILESCC1CN(C2CCN(Cc3ccccn3)CC2)CC(C)O1
InChIInChI=1S/C17H27N3O/c1-14-11-20(12-15(2)21-14)17-6-9-19(10-7-17)13-16-5-3-4-8-18-16/h3-5,8,14-15,17H,6-7,9-13H2,1-2H3
InChIKeyRFBDWXWUTHLRTG-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.16
Rot. Bonds3

About 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine

2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine (PubChem CID 2912309) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine
PubChem CID2912309
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine
SMILESCC1CN(C2CCN(Cc3ccccn3)CC2)CC(C)O1
InChIInChI=1S/C17H27N3O/c1-14-11-20(12-15(2)21-14)17-6-9-19(10-7-17)13-16-5-3-4-8-18-16/h3-5,8,14-15,17H,6-7,9-13H2,1-2H3
InChIKeyRFBDWXWUTHLRTG-UHFFFAOYSA-N
XLogP2.16
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine (CID 2912309) is 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine is CC1CN(C2CCN(Cc3ccccn3)CC2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine?
The InChIKey is RFBDWXWUTHLRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-14-11-20(12-15(2)21-14)17-6-9-19(10-7-17)13-16-5-3-4-8-18-16/h3-5,8,14-15,17H,6-7,9-13H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine?
2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine has a molecular weight of 289.42 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]morpholine is sourced from PubChem (CID 2912309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).