1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one

C15H18N4O — CID 53319742

IUPAC1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one
SMILESCn1c(N2CCCCC2)cc(-c2ccncn2)cc1=O
InChIInChI=1S/C15H18N4O/c1-18-14(19-7-3-2-4-8-19)9-12(10-15(18)20)13-5-6-16-11-17-13/h5-6,9-11H,2-4,7-8H2,1H3
InChIKeyCJXGLFGPTQWYLK-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.83
Rot. Bonds2

About 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one

1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one (PubChem CID 53319742) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one.

Molecular Properties

Compound Name1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one
PubChem CID53319742
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one
SMILESCn1c(N2CCCCC2)cc(-c2ccncn2)cc1=O
InChIInChI=1S/C15H18N4O/c1-18-14(19-7-3-2-4-8-19)9-12(10-15(18)20)13-5-6-16-11-17-13/h5-6,9-11H,2-4,7-8H2,1H3
InChIKeyCJXGLFGPTQWYLK-UHFFFAOYSA-N
XLogP1.83
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2R)-4-(2-fluorophenyl)-2-methylpiperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005631
2-[(2R)-4-(3-fluorophenyl)-2-methylpiperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005985
2-[(2R)-4-(4-fluorophenyl)-2-methylpiperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005986
C2 Pyrido[2,3-d]pyrimidin-7-one deriv. 22
CID 5330208
1-methyl-2-((2R)-2-methyl-piperazin-1-yl)-1H-[4,4']bipyrimidinyl-6-one
CID 25004596
3-methyl-2-[(2S)-2-methylpiperazin-1-yl]-6-pyrimidin-4-ylpyrimidin-4-one
CID 25004927
2-[(2R)-2,4-dimethylpiperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one
CID 25004929
2-[(2R)-4-acetyl-2-methylpiperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005271
methyl (3R)-3-methyl-4-(1-methyl-6-oxo-4-pyrimidin-4-ylpyrimidin-2-yl)piperazine-1-carboxylate
CID 25005627
2-[(2R)-4-benzyl-2-methylpiperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005628
3-methyl-2-[(2R)-2-methyl-4-phenylpiperazin-1-yl]-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005629
3-methyl-2-[(2R)-2-methyl-4-propan-2-ylpiperazin-1-yl]-6-pyrimidin-4-ylpyrimidin-4-one
CID 25005990

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one?
The IUPAC name of 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one (CID 53319742) is 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one.
What is the SMILES notation for 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one?
The canonical SMILES for 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one is Cn1c(N2CCCCC2)cc(-c2ccncn2)cc1=O.
What is the InChIKey of 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one?
The InChIKey is CJXGLFGPTQWYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-18-14(19-7-3-2-4-8-19)9-12(10-15(18)20)13-5-6-16-11-17-13/h5-6,9-11H,2-4,7-8H2,1H3.
What are the key properties of 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one?
1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one has a molecular weight of 270.34 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-piperidin-1-yl-4-pyrimidin-4-ylpyridin-2-one is sourced from PubChem (CID 53319742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).