4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one

C10H17N3O2 — CID 103241419

IUPAC4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one
SMILESCCN(CC)CCOc1cc(=O)[nH]cn1
InChIInChI=1S/C10H17N3O2/c1-3-13(4-2)5-6-15-10-7-9(14)11-8-12-10/h7-8H,3-6H2,1-2H3,(H,11,12,14)
InChIKeyNXZXUDDBBAZLCT-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.49
Rot. Bonds6

About 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one

4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one (PubChem CID 103241419) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one
PubChem CID103241419
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one
SMILESCCN(CC)CCOc1cc(=O)[nH]cn1
InChIInChI=1S/C10H17N3O2/c1-3-13(4-2)5-6-15-10-7-9(14)11-8-12-10/h7-8H,3-6H2,1-2H3,(H,11,12,14)
InChIKeyNXZXUDDBBAZLCT-UHFFFAOYSA-N
XLogP0.49
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-Amino-3-(2-ethoxyethyl)pyrimidin-4-one
CID 23525168
6-ethoxypyrimidin-4(1H)-one
CID 45080261
4-(2-methylpropoxy)-1H-pyrimidin-6-one
CID 59665181
4-propoxy-1H-pyrimidin-6-one
CID 89293896
6-Ethoxy-1,3-diethylpyrimidin-1-ium-4-one
CID 12335020
3-[3-(2-Methoxyethylamino)propyl]pyrimidin-4-one
CID 63768489
3-[2-(2-Ethoxyethylamino)ethyl]pyrimidin-4-one
CID 63793493
3-[4-(2-Methoxyethylamino)butyl]pyrimidin-4-one
CID 63794386
3-[2-(2-Methoxyethylamino)ethyl]pyrimidin-4-one
CID 63795261
4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
CID 102741500
4-butoxy-1H-pyrimidin-6-one
CID 103240838
4-butan-2-yloxy-1H-pyrimidin-6-one
CID 103240861

Frequently Asked Questions

What is the IUPAC name of 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one?
The IUPAC name of 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one (CID 103241419) is 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one?
The canonical SMILES for 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one is CCN(CC)CCOc1cc(=O)[nH]cn1.
What is the InChIKey of 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one?
The InChIKey is NXZXUDDBBAZLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-13(4-2)5-6-15-10-7-9(14)11-8-12-10/h7-8H,3-6H2,1-2H3,(H,11,12,14).
What are the key properties of 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one?
4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one has a molecular weight of 211.26 g/mol, XLogP of 0.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one is sourced from PubChem (CID 103241419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).