4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine

C15H24N4O — CID 133309507

IUPAC4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine
SMILESCc1ccnc(N2CCCCC2CN2CCOCC2)n1
InChIInChI=1S/C15H24N4O/c1-13-5-6-16-15(17-13)19-7-3-2-4-14(19)12-18-8-10-20-11-9-18/h5-6,14H,2-4,7-12H2,1H3
InChIKeyKEEHDFBWOPGZGH-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.48
Rot. Bonds3

About 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine

4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine (PubChem CID 133309507) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine
PubChem CID133309507
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine
SMILESCc1ccnc(N2CCCCC2CN2CCOCC2)n1
InChIInChI=1S/C15H24N4O/c1-13-5-6-16-15(17-13)19-7-3-2-4-14(19)12-18-8-10-20-11-9-18/h5-6,14H,2-4,7-12H2,1H3
InChIKeyKEEHDFBWOPGZGH-UHFFFAOYSA-N
XLogP1.48
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine?
The IUPAC name of 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine (CID 133309507) is 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine is Cc1ccnc(N2CCCCC2CN2CCOCC2)n1.
What is the InChIKey of 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine?
The InChIKey is KEEHDFBWOPGZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-13-5-6-16-15(17-13)19-7-3-2-4-14(19)12-18-8-10-20-11-9-18/h5-6,14H,2-4,7-12H2,1H3.
What are the key properties of 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine?
4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine has a molecular weight of 276.38 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]morpholine is sourced from PubChem (CID 133309507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).