1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione

C11H18N2O4 — CID 69181242

IUPAC1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione
SMILESCOC(C)n1c(C)cc(=O)n(C(C)OC)c1=O
InChIInChI=1S/C11H18N2O4/c1-7-6-10(14)13(9(3)17-5)11(15)12(7)8(2)16-4/h6,8-9H,1-5H3
InChIKeyFLBSRSGLYQJFCV-UHFFFAOYSA-N
MW242.27 g/mol
LogP0.65
Rot. Bonds4

About 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione

1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione (PubChem CID 69181242) has the molecular formula C11H18N2O4 and a molecular weight of 242.27 g/mol. Its IUPAC name is 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione
PubChem CID69181242
Molecular FormulaC11H18N2O4
Molecular Weight242.27 g/mol
Exact Mass242.13
IUPAC Name1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione
SMILESCOC(C)n1c(C)cc(=O)n(C(C)OC)c1=O
InChIInChI=1S/C11H18N2O4/c1-7-6-10(14)13(9(3)17-5)11(15)12(7)8(2)16-4/h6,8-9H,1-5H3
InChIKeyFLBSRSGLYQJFCV-UHFFFAOYSA-N
XLogP0.65
TPSA62.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1,3,6-Trimethyl-2,4(1H,3H)-pyrimidinedione
CID 26075
N(1),N(3)-Diallyl-6-methyluracil
CID 173882
1,6-Dimethyl-3-ethyluracil
CID 21627127
1-(2-Bromoethyl)-3,6-dimethyl-2,4(1H,3H)-pyrimidinedione
CID 3474051
3,6-Dimethyl-1-[5-(diethylamino)pentyl]uracil
CID 3125139
1,3-Bis(2-hydroxyethyl)-6-methylpyrimidine-2,4(1H,3H)-dione
CID 2783724
1,3-Diethyl-6-methyluracil
CID 12357931
1,3-Bis(1-(allyloxy)ethyl)-6-methyl-2,4(1H,3H)-pyrimidinedione
CID 375737
6-[[Butan-2-yl(2-methoxyethyl)amino]methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 47040062
2,4(1H,3H)-Pyrimidinedione, 6-methyl-3-(1-methylpropyl)-, sodium salt (1:1)
CID 13613053
1-(2-Dimethylamino-ethyl)-3,6-dimethyl-1H-pyrimidine-2,4-dione
CID 547155
1-Ethyl-3,6-dimethylpyrimidine-2,4-dione
CID 10866731

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione?
The IUPAC name of 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione (CID 69181242) is 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione.
What is the SMILES notation for 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione?
The canonical SMILES for 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione is COC(C)n1c(C)cc(=O)n(C(C)OC)c1=O.
What is the InChIKey of 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione?
The InChIKey is FLBSRSGLYQJFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c1-7-6-10(14)13(9(3)17-5)11(15)12(7)8(2)16-4/h6,8-9H,1-5H3.
What are the key properties of 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione?
1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione has a molecular weight of 242.27 g/mol, XLogP of 0.65, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(1-methoxyethyl)-6-methylpyrimidine-2,4-dione is sourced from PubChem (CID 69181242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).