2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one

C10H18N4O2 — CID 23525155

IUPAC2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one
SMILESCCOCCn1c(N)nc(N(C)C)cc1=O
InChIInChI=1S/C10H18N4O2/c1-4-16-6-5-14-9(15)7-8(13(2)3)12-10(14)11/h7H,4-6H2,1-3H3,(H2,11,12)
InChIKeyVBKGNQSNXASCJD-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.07
Rot. Bonds5

About 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one

2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one (PubChem CID 23525155) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one.

Molecular Properties

Compound Name2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one
PubChem CID23525155
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one
SMILESCCOCCn1c(N)nc(N(C)C)cc1=O
InChIInChI=1S/C10H18N4O2/c1-4-16-6-5-14-9(15)7-8(13(2)3)12-10(14)11/h7H,4-6H2,1-3H3,(H2,11,12)
InChIKeyVBKGNQSNXASCJD-UHFFFAOYSA-N
XLogP-0.07
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-Amino-4-(dimethylamino)-6-oxo-pyrimidin-1-yl]ethoxymethylphosphonic acid
CID 493052
2-amino-6-morpholin-4-ylpyrimidin-4(3H)-one
CID 135512317
2-(dimethylamino)-6-morpholinopyrimidin-4(3H)-one
CID 136188794
6-Amino-2-(morpholin-4-yl)pyrimidin-4(1H)-one
CID 135587491
1,3-Dimethyl-6-(morpholinomethyleneamino)pyrimidine-2,4-dione
CID 101563465
4-Morpholin-4-yl-6-oxopyrimidine-1-carboxamide
CID 123522893
6-Amino-2-methoxy-3-[2-(2-bromoethoxy)ethyl]-4-pyrimidone
CID 10214847
6-Amino-2-methoxy-3-[2-(2-methoxyethoxy)ethyl]-4-pyrimidone
CID 11492462
2-(Dimethylamino)-3-(2-methoxyethyl)-6-methylpyrimidin-4-one
CID 20745847
2,6-Diamino-3-(2-ethoxyethyl)pyrimidin-4-one
CID 23525147
2-Amino-3-(2-ethoxyethyl)-6-methylpyrimidin-4-one
CID 23525149
2-Amino-6-(2-ethoxyethoxy)-3-(2-ethoxyethyl)pyrimidin-4-one
CID 23525151

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one?
The IUPAC name of 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one (CID 23525155) is 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one.
What is the SMILES notation for 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one?
The canonical SMILES for 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one is CCOCCn1c(N)nc(N(C)C)cc1=O.
What is the InChIKey of 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one?
The InChIKey is VBKGNQSNXASCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-4-16-6-5-14-9(15)7-8(13(2)3)12-10(14)11/h7H,4-6H2,1-3H3,(H2,11,12).
What are the key properties of 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one?
2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one has a molecular weight of 226.28 g/mol, XLogP of -0.07, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one is sourced from PubChem (CID 23525155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).