5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one

C8H14N4O2 — CID 137009396

IUPAC5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one
SMILESCOCCN(C)c1nc[nH]c(=O)c1N
InChIInChI=1S/C8H14N4O2/c1-12(3-4-14-2)7-6(9)8(13)11-5-10-7/h5H,3-4,9H2,1-2H3,(H,10,11,13)
InChIKeyFEUULRQMJAUWJY-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.57
Rot. Bonds4

About 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one

5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one (PubChem CID 137009396) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one
PubChem CID137009396
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one
SMILESCOCCN(C)c1nc[nH]c(=O)c1N
InChIInChI=1S/C8H14N4O2/c1-12(3-4-14-2)7-6(9)8(13)11-5-10-7/h5H,3-4,9H2,1-2H3,(H,10,11,13)
InChIKeyFEUULRQMJAUWJY-UHFFFAOYSA-N
XLogP-0.57
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-4-[methyl(2-propan-2-yloxyethyl)amino]-1H-pyrimidin-6-one
CID 137009854
2-[(5-amino-6-oxo-1H-pyrimidin-4-yl)-(2-methoxyethyl)amino]acetic acid
CID 136958649
5-amino-4-[(2-hydroxy-3-methoxypropyl)-methylamino]-1H-pyrimidin-6-one
CID 136979598
2-[(5-amino-6-oxo-1H-pyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 137009322
3-[(5-amino-6-oxo-1H-pyrimidin-4-yl)-(2-methoxyethyl)amino]propanenitrile
CID 137016005
5-bromo-4-[3-methoxypropyl(methyl)amino]-1H-pyrimidin-6-one
CID 136957802
5-methoxy-4-[3-methoxypropyl(methyl)amino]-1H-pyrimidin-6-one
CID 137009559
3-[2-methoxyethyl(methyl)amino]-1H-pyrazin-2-one
CID 115657141
5-amino-4-[methyl(2-methylbutyl)amino]-1H-pyrimidin-6-one
CID 137009099
2-[(5-amino-6-oxo-1H-pyrimidin-4-yl)-methylamino]-N,N-diethylacetamide
CID 136989947
5-amino-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1H-pyrimidin-6-one
CID 103241963
5-amino-4-[ethyl(propyl)amino]-1H-pyrimidin-6-one
CID 137009081

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one (CID 137009396) is 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one is COCCN(C)c1nc[nH]c(=O)c1N.
What is the InChIKey of 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one?
The InChIKey is FEUULRQMJAUWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-12(3-4-14-2)7-6(9)8(13)11-5-10-7/h5H,3-4,9H2,1-2H3,(H,10,11,13).
What are the key properties of 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one?
5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one has a molecular weight of 198.23 g/mol, XLogP of -0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-[2-methoxyethyl(methyl)amino]-1H-pyrimidin-6-one is sourced from PubChem (CID 137009396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).