[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone

C15H22N4O2 — CID 109298958

IUPAC[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
SMILESCC1CCN(c2nccc(C(=O)N3CCOCC3)n2)CC1
InChIInChI=1S/C15H22N4O2/c1-12-3-6-19(7-4-12)15-16-5-2-13(17-15)14(20)18-8-10-21-11-9-18/h2,5,12H,3-4,6-11H2,1H3
InChIKeyXXOGELFRJMUMRK-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.19
Rot. Bonds2

About [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone

[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 109298958) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
PubChem CID109298958
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
SMILESCC1CCN(c2nccc(C(=O)N3CCOCC3)n2)CC1
InChIInChI=1S/C15H22N4O2/c1-12-3-6-19(7-4-12)15-16-5-2-13(17-15)14(20)18-8-10-21-11-9-18/h2,5,12H,3-4,6-11H2,1H3
InChIKeyXXOGELFRJMUMRK-UHFFFAOYSA-N
XLogP1.19
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(furan-2-carbonyl)piperazin-1-yl]-[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]methanone
CID 109299007
[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109310659
(4-methylpiperazin-1-yl)-[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methanone
CID 109302257
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methanone
CID 109310002
(4-methylpiperidin-1-yl)-[6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-2-pyridinyl]methanone
CID 109095456
azepan-1-yl-(2-pyrrolidin-1-ylpyrimidin-4-yl)methanone
CID 109297545
[1-[4-(morpholine-4-carbonyl)pyrimidin-2-yl]piperidin-4-yl]-(3-phenyl-3,4-dihydropyrazol-2-yl)methanone
CID 134521292
[6-(morpholine-4-carbonyl)-2-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109096023
N-cyclopentyl-2-(4-methylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109298035
2,3-dihydroindol-1-yl-[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]methanone
CID 109299032
(2-aminopyrimidin-4-yl)-morpholin-4-ylmethanone
CID 117212768
1-(2-morpholin-4-ylpyrimidin-4-yl)propan-1-one
CID 170035961

Frequently Asked Questions

What is the IUPAC name of [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone (CID 109298958) is [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone is CC1CCN(c2nccc(C(=O)N3CCOCC3)n2)CC1.
What is the InChIKey of [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is XXOGELFRJMUMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-12-3-6-19(7-4-12)15-16-5-2-13(17-15)14(20)18-8-10-21-11-9-18/h2,5,12H,3-4,6-11H2,1H3.
What are the key properties of [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone?
[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 290.37 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 109298958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).