6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one

C14H18N4O — CID 53326306

IUPAC6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one
SMILESCCN(CC)c1cc(-c2ccncn2)cc(=O)n1C
InChIInChI=1S/C14H18N4O/c1-4-18(5-2)13-8-11(9-14(19)17(13)3)12-6-7-15-10-16-12/h6-10H,4-5H2,1-3H3
InChIKeyYDSLUUMLFXCJOX-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.69
Rot. Bonds4

About 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one

6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one (PubChem CID 53326306) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one.

Molecular Properties

Compound Name6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one
PubChem CID53326306
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one
SMILESCCN(CC)c1cc(-c2ccncn2)cc(=O)n1C
InChIInChI=1S/C14H18N4O/c1-4-18(5-2)13-8-11(9-14(19)17(13)3)12-6-7-15-10-16-12/h6-10H,4-5H2,1-3H3
InChIKeyYDSLUUMLFXCJOX-UHFFFAOYSA-N
XLogP1.69
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one?
The IUPAC name of 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one (CID 53326306) is 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one.
What is the SMILES notation for 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one?
The canonical SMILES for 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one is CCN(CC)c1cc(-c2ccncn2)cc(=O)n1C.
What is the InChIKey of 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one?
The InChIKey is YDSLUUMLFXCJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-18(5-2)13-8-11(9-14(19)17(13)3)12-6-7-15-10-16-12/h6-10H,4-5H2,1-3H3.
What are the key properties of 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one?
6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one has a molecular weight of 258.32 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylamino)-1-methyl-4-pyrimidin-4-ylpyridin-2-one is sourced from PubChem (CID 53326306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).