1-(methoxymethyl)pyrimidine-2,4-dione

C6H8N2O3 — CID 642665

IUPAC1-(methoxymethyl)pyrimidine-2,4-dione
SMILESCOCn1ccc(=O)[nH]c1=O
InChIInChI=1S/C6H8N2O3/c1-11-4-8-3-2-5(9)7-6(8)10/h2-3H,4H2,1H3,(H,7,9,10)
InChIKeyJCFPRDZTQIDTMH-UHFFFAOYSA-N
MW156.14 g/mol
LogP-0.86
Rot. Bonds2

About 1-(methoxymethyl)pyrimidine-2,4-dione

1-(methoxymethyl)pyrimidine-2,4-dione (PubChem CID 642665) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is 1-(methoxymethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-(methoxymethyl)pyrimidine-2,4-dione
PubChem CID642665
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC Name1-(methoxymethyl)pyrimidine-2,4-dione
SMILESCOCn1ccc(=O)[nH]c1=O
InChIInChI=1S/C6H8N2O3/c1-11-4-8-3-2-5(9)7-6(8)10/h2-3H,4H2,1H3,(H,7,9,10)
InChIKeyJCFPRDZTQIDTMH-UHFFFAOYSA-N
XLogP-0.86
TPSA64.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Uracil
CID 1174
3-Methyluracil
CID 79066
1,3-Dimethyluracil
CID 70122
1-Methyluracil
CID 12009
1-Ethyluracil
CID 4183135
6-Amino-1-methyluracil
CID 75520
6-Amino-1-propyluracil
CID 104562
6-Amino-1-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 853899
1,3-Dimethyl-6-(propylamino)pyrimidine-2,4-dione
CID 2262138
2,4(1H,3H)-Pyrimidinedione, 1-((2-propenyloxy)methyl)-
CID 376599
6-Amino-1-butyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2428996
6-Amino-1-(2-methoxyethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 1644232

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)pyrimidine-2,4-dione?
The IUPAC name of 1-(methoxymethyl)pyrimidine-2,4-dione (CID 642665) is 1-(methoxymethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 1-(methoxymethyl)pyrimidine-2,4-dione?
The canonical SMILES for 1-(methoxymethyl)pyrimidine-2,4-dione is COCn1ccc(=O)[nH]c1=O.
What is the InChIKey of 1-(methoxymethyl)pyrimidine-2,4-dione?
The InChIKey is JCFPRDZTQIDTMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c1-11-4-8-3-2-5(9)7-6(8)10/h2-3H,4H2,1H3,(H,7,9,10).
What are the key properties of 1-(methoxymethyl)pyrimidine-2,4-dione?
1-(methoxymethyl)pyrimidine-2,4-dione has a molecular weight of 156.14 g/mol, XLogP of -0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 642665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).