1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione

C15H20N4O3 — CID 146144159

IUPAC1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione
SMILESCCCn1cc(NCc2cc(=O)n(C)c(=O)n2C)ccc1=O
InChIInChI=1S/C15H20N4O3/c1-4-7-19-10-11(5-6-13(19)20)16-9-12-8-14(21)18(3)15(22)17(12)2/h5-6,8,10,16H,4,7,9H2,1-3H3
InChIKeyCKULGYYRWFHIGN-UHFFFAOYSA-N
MW304.35 g/mol
LogP0.27
Rot. Bonds5

About 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione

1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione (PubChem CID 146144159) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione
PubChem CID146144159
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione
SMILESCCCn1cc(NCc2cc(=O)n(C)c(=O)n2C)ccc1=O
InChIInChI=1S/C15H20N4O3/c1-4-7-19-10-11(5-6-13(19)20)16-9-12-8-14(21)18(3)15(22)17(12)2/h5-6,8,10,16H,4,7,9H2,1-3H3
InChIKeyCKULGYYRWFHIGN-UHFFFAOYSA-N
XLogP0.27
TPSA78.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione (CID 146144159) is 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione is CCCn1cc(NCc2cc(=O)n(C)c(=O)n2C)ccc1=O.
What is the InChIKey of 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione?
The InChIKey is CKULGYYRWFHIGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-4-7-19-10-11(5-6-13(19)20)16-9-12-8-14(21)18(3)15(22)17(12)2/h5-6,8,10,16H,4,7,9H2,1-3H3.
What are the key properties of 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione?
1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione has a molecular weight of 304.35 g/mol, XLogP of 0.27, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-6-[[(6-oxo-1-propyl-3-pyridinyl)amino]methyl]pyrimidine-2,4-dione is sourced from PubChem (CID 146144159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).