4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine

C15H24N4O — CID 155555557

IUPAC4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine
SMILESCC1(C)CCCN(c2cc(N3CCOCC3)ncn2)C1
InChIInChI=1S/C15H24N4O/c1-15(2)4-3-5-19(11-15)14-10-13(16-12-17-14)18-6-8-20-9-7-18/h10,12H,3-9,11H2,1-2H3
InChIKeyWNHSXIZMFNIZOT-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.94
Rot. Bonds2

About 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine

4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine (PubChem CID 155555557) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine
PubChem CID155555557
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine
SMILESCC1(C)CCCN(c2cc(N3CCOCC3)ncn2)C1
InChIInChI=1S/C15H24N4O/c1-15(2)4-3-5-19(11-15)14-10-13(16-12-17-14)18-6-8-20-9-7-18/h10,12H,3-9,11H2,1-2H3
InChIKeyWNHSXIZMFNIZOT-UHFFFAOYSA-N
XLogP1.94
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine (CID 155555557) is 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine is CC1(C)CCCN(c2cc(N3CCOCC3)ncn2)C1.
What is the InChIKey of 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine?
The InChIKey is WNHSXIZMFNIZOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-15(2)4-3-5-19(11-15)14-10-13(16-12-17-14)18-6-8-20-9-7-18/h10,12H,3-9,11H2,1-2H3.
What are the key properties of 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine?
4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine has a molecular weight of 276.38 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(3,3-dimethylpiperidin-1-yl)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 155555557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).