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

C11H18N2O4 — CID 69181243

IUPAC1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione
SMILESCOCCn1c(C)cc(=O)n(CCOC)c1=O
InChIInChI=1S/C11H18N2O4/c1-9-8-10(14)13(5-7-17-3)11(15)12(9)4-6-16-2/h8H,4-7H2,1-3H3
InChIKeyNWZHMVZQTCBMTB-UHFFFAOYSA-N
MW242.27 g/mol
LogP-0.39
Rot. Bonds6

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

1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione (PubChem CID 69181243) has the molecular formula C11H18N2O4 and a molecular weight of 242.27 g/mol. Its IUPAC name is 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione
PubChem CID69181243
Molecular FormulaC11H18N2O4
Molecular Weight242.27 g/mol
Exact Mass242.13
IUPAC Name1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione
SMILESCOCCn1c(C)cc(=O)n(CCOC)c1=O
InChIInChI=1S/C11H18N2O4/c1-9-8-10(14)13(5-7-17-3)11(15)12(9)4-6-16-2/h8H,4-7H2,1-3H3
InChIKeyNWZHMVZQTCBMTB-UHFFFAOYSA-N
XLogP-0.39
TPSA62.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 5-0.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N(1),N(3)-Diallyl-6-methyluracil
CID 173882
1,6-Dimethyl-3-ethyluracil
CID 21627127
1,3-dimethyl-6-[(E)-2-morpholin-4-ylethenyl]pyrimidine-2,4-dione
CID 2332060
1,3-Bis(2-hydroxyethyl)-6-methylpyrimidine-2,4(1H,3H)-dione
CID 2783724
1,3-Diethyl-6-methyluracil
CID 12357931
1,3-Bis-(2-methoxyethyl)uracil
CID 86291685
1,3-Bis(1-(allyloxy)ethyl)-6-methyl-2,4(1H,3H)-pyrimidinedione
CID 375737
1,3-Dimethyl-6-(morpholin-4-ylmethyl)pyrimidine-2,4-dione
CID 13014893
1,3-Dimethyl-6-[(3-methylmorpholin-4-yl)methyl]pyrimidine-2,4-dione
CID 45813887
6-[[Butan-2-yl(2-methoxyethyl)amino]methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 47040062
1-(2-Dimethylamino-ethyl)-3,6-dimethyl-1H-pyrimidine-2,4-dione
CID 547155
Pyrimidine-2,4-dione, hexahydro-3,6-dimethyl-1-(4-morpholinobutyl)-
CID 567606

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione?
The IUPAC name of 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione (CID 69181243) is 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione.
What is the SMILES notation for 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione?
The canonical SMILES for 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione is COCCn1c(C)cc(=O)n(CCOC)c1=O.
What is the InChIKey of 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione?
The InChIKey is NWZHMVZQTCBMTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c1-9-8-10(14)13(5-7-17-3)11(15)12(9)4-6-16-2/h8H,4-7H2,1-3H3.
What are the key properties of 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione?
1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione has a molecular weight of 242.27 g/mol, XLogP of -0.39, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2-methoxyethyl)-6-methylpyrimidine-2,4-dione is sourced from PubChem (CID 69181243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).