2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide

C13H20N4O3 — CID 9406707

IUPAC2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide
SMILESCCCNC(=O)CNC(=O)Cc1c(C)nc(=O)[nH]c1C
InChIInChI=1S/C13H20N4O3/c1-4-5-14-12(19)7-15-11(18)6-10-8(2)16-13(20)17-9(10)3/h4-7H2,1-3H3,(H,14,19)(H,15,18)(H,16,17,20)
InChIKeyQRZHLOOTGICYRH-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.43
Rot. Bonds6

About 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide

2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide (PubChem CID 9406707) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide
PubChem CID9406707
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC Name2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide
SMILESCCCNC(=O)CNC(=O)Cc1c(C)nc(=O)[nH]c1C
InChIInChI=1S/C13H20N4O3/c1-4-5-14-12(19)7-15-11(18)6-10-8(2)16-13(20)17-9(10)3/h4-7H2,1-3H3,(H,14,19)(H,15,18)(H,16,17,20)
InChIKeyQRZHLOOTGICYRH-UHFFFAOYSA-N
XLogP-0.43
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N~2~-[3-(2-hydroxy-4,6-dimethylpyrimidin-5-yl)propanoyl]-N~1~,N~1~-dimethylalaninamide
CID 56746306
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-prop-2-enylacetamide
CID 9400049
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]acetamide
CID 9405707
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]acetamide
CID 9405708
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 9406387
N-[2-(dimethylamino)-2-oxoethyl]-2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetamide
CID 9406635
2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 9489421
N-[2-(dimethylamino)-2-oxoethyl]-2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)acetamide
CID 9513839
2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 9517300
2-[[2-[[2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetyl]amino]acetyl]amino]acetic acid
CID 43465472
N-cyclohexyl-2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetamide
CID 60675842
N-butan-2-yl-2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetamide
CID 60675879

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide?
The IUPAC name of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide (CID 9406707) is 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide.
What is the SMILES notation for 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide?
The canonical SMILES for 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide is CCCNC(=O)CNC(=O)Cc1c(C)nc(=O)[nH]c1C.
What is the InChIKey of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide?
The InChIKey is QRZHLOOTGICYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c1-4-5-14-12(19)7-15-11(18)6-10-8(2)16-13(20)17-9(10)3/h4-7H2,1-3H3,(H,14,19)(H,15,18)(H,16,17,20).
What are the key properties of 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide?
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide has a molecular weight of 280.33 g/mol, XLogP of -0.43, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide is sourced from PubChem (CID 9406707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).