6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione

C7H10BrN3O3 — CID 2389933

IUPAC6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione
SMILESCOCCn1c(N)c(Br)c(=O)[nH]c1=O
InChIInChI=1S/C7H10BrN3O3/c1-14-3-2-11-5(9)4(8)6(12)10-7(11)13/h2-3,9H2,1H3,(H,10,12,13)
InChIKeyUGMDAXMHQYFURQ-UHFFFAOYSA-N
MW264.08 g/mol
LogP-0.47
Rot. Bonds3

About 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione

6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione (PubChem CID 2389933) has the molecular formula C7H10BrN3O3 and a molecular weight of 264.08 g/mol. Its IUPAC name is 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione
PubChem CID2389933
Molecular FormulaC7H10BrN3O3
Molecular Weight264.08 g/mol
Exact Mass262.99
IUPAC Name6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione
SMILESCOCCn1c(N)c(Br)c(=O)[nH]c1=O
InChIInChI=1S/C7H10BrN3O3/c1-14-3-2-11-5(9)4(8)6(12)10-7(11)13/h2-3,9H2,1H3,(H,10,12,13)
InChIKeyUGMDAXMHQYFURQ-UHFFFAOYSA-N
XLogP-0.47
TPSA90.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.08
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-5-bromo-1-(2-methylpropyl)pyrimidine-2,4-dione
CID 2432599
6-amino-5-bromo-1-(2-phenylethyl)pyrimidine-2,4-dione
CID 17333776
6-amino-1-(2-methoxyethyl)-5-(2-propan-2-yloxyethylamino)pyrimidine-2,4-dione
CID 104762438
6-amino-5-(hexylamino)-1-(2-methoxyethyl)pyrimidine-2,4-dione
CID 60649236
8-amino-3-(2-methoxyethyl)-7H-purine-2,6-dione
CID 82465398
6-amino-5-[3-(hydroxymethyl)pentan-3-ylamino]-1-(2-methoxyethyl)pyrimidine-2,4-dione
CID 62517996
6-amino-5-(3-hydroxy-4-methylpiperidin-1-yl)-1-(2-methoxyethyl)pyrimidine-2,4-dione
CID 102959382
6-amino-1-(2-methoxyethyl)-5-[[1-(trifluoromethyl)cyclopropyl]amino]pyrimidine-2,4-dione
CID 106214870
6-amino-1-(2-methoxyethyl)-5-[(5-oxopyrrolidin-3-yl)amino]pyrimidine-2,4-dione
CID 106192155
5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione
CID 63778343
5-amino-3-(2-methoxyethyl)-2-oxo-1H-imidazole-4-carboxylic acid
CID 82469457
6-amino-5-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)amino]-1-(2-methoxyethyl)pyrimidine-2,4-dione
CID 60661650

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione?
The IUPAC name of 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione (CID 2389933) is 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione is COCCn1c(N)c(Br)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione?
The InChIKey is UGMDAXMHQYFURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10BrN3O3/c1-14-3-2-11-5(9)4(8)6(12)10-7(11)13/h2-3,9H2,1H3,(H,10,12,13).
What are the key properties of 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione?
6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione has a molecular weight of 264.08 g/mol, XLogP of -0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-bromo-1-(2-methoxyethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 2389933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).