4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine

C13H20N4O — CID 112884623

IUPAC4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine
SMILESc1cc(N2CCOCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C13H20N4O/c1-2-6-17(7-3-1)13-14-5-4-12(15-13)16-8-10-18-11-9-16/h4-5H,1-3,6-11H2
InChIKeyHAMBJZBACSKMPG-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.30
Rot. Bonds2

About 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine

4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine (PubChem CID 112884623) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine
PubChem CID112884623
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine
SMILESc1cc(N2CCOCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C13H20N4O/c1-2-6-17(7-3-1)13-14-5-4-12(15-13)16-8-10-18-11-9-16/h4-5H,1-3,6-11H2
InChIKeyHAMBJZBACSKMPG-UHFFFAOYSA-N
XLogP1.30
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-pyrrolidin-1-ylpyrimidin-2-yl)azepane
CID 112883879
4-[4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 122344638
4-[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 112886572
1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-2-yl]azepane
CID 112898909
cyclohexyl-[4-(2-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 70703659
4-piperazin-1-yl-2-piperidin-1-ylpyrimidine
CID 83724540
2-(4-pyridin-4-ylpiperazin-1-yl)-4-pyrrolidin-1-ylpyrimidine
CID 165432779
1-morpholin-4-yl-2-[4-(2-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethanone
CID 154829686
4-[4-(4-benzylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 112886571
4-(2-morpholin-4-yl-6-pyrrolidin-1-ylpyrimidin-4-yl)morpholine
CID 67897493
1-[2-(4-ethylpiperazin-1-yl)pyrimidin-4-yl]azepane
CID 112888441
4-[[(3S)-1-(4-pyrrolidin-1-ylpyrimidin-2-yl)piperidin-3-yl]methyl]morpholine
CID 97318478

Frequently Asked Questions

What is the IUPAC name of 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine?
The IUPAC name of 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine (CID 112884623) is 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine is c1cc(N2CCOCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine?
The InChIKey is HAMBJZBACSKMPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-6-17(7-3-1)13-14-5-4-12(15-13)16-8-10-18-11-9-16/h4-5H,1-3,6-11H2.
What are the key properties of 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine?
4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine has a molecular weight of 248.33 g/mol, XLogP of 1.30, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 112884623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).