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

C10H17N3O2 — CID 63611915

IUPAC2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one
SMILESCCN(CC)CCc1nc(O)cc(=O)[nH]1
InChIInChI=1S/C10H17N3O2/c1-3-13(4-2)6-5-8-11-9(14)7-10(15)12-8/h7H,3-6H2,1-2H3,(H2,11,12,14,15)
InChIKeyXGSLCRIUTWPRFL-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.36
Rot. Bonds5

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

2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one (PubChem CID 63611915) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one
PubChem CID63611915
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one
SMILESCCN(CC)CCc1nc(O)cc(=O)[nH]1
InChIInChI=1S/C10H17N3O2/c1-3-13(4-2)6-5-8-11-9(14)7-10(15)12-8/h7H,3-6H2,1-2H3,(H2,11,12,14,15)
InChIKeyXGSLCRIUTWPRFL-UHFFFAOYSA-N
XLogP0.36
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Propylpyrimidine-4,6-diol
CID 12280642
AC1Ldwnn
CID 676463
2-(3-Aminopropyl)-6-hydroxy-3,4-dihydropyrimidin-4-one hydrochloride
CID 165604793
2-Ethyl-4,6-dihydroxypyrimidine
CID 520836
2-(3-Aminopropyl)pyrimidine-4,6-diol
CID 63554638
5-fluoro-4-hydroxy-2-[2-(methylamino)ethyl]-1H-pyrimidin-6-one
CID 80550892
2-Tert-butyl-4,6-dihydroxypyrimidine
CID 817310
2-Butyl-6-hydroxypyrimidin-4(1H)-one
CID 12280643
2-[(dimethylamino)methyl]-4-hydroxy-1H-pyrimidin-6-one
CID 67282495
2-(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)-N,N-dimethylacetamide
CID 67282633
2-[[di(propan-2-yl)amino]methyl]-4-hydroxy-1H-pyrimidin-6-one
CID 67282636
2,3-Diethyl-6-hydroxypyrimidin-4-one
CID 135617178

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one?
The IUPAC name of 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one (CID 63611915) is 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one is CCN(CC)CCc1nc(O)cc(=O)[nH]1.
What is the InChIKey of 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one?
The InChIKey is XGSLCRIUTWPRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-13(4-2)6-5-8-11-9(14)7-10(15)12-8/h7H,3-6H2,1-2H3,(H2,11,12,14,15).
What are the key properties of 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one?
2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one has a molecular weight of 211.26 g/mol, XLogP of 0.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)ethyl]-4-hydroxy-1H-pyrimidin-6-one is sourced from PubChem (CID 63611915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).