4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one

C11H12N4O2 — CID 137012354

IUPAC4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one
SMILESCCc1cc(=O)[nH]c(-c2ccc(OC)nn2)n1
InChIInChI=1S/C11H12N4O2/c1-3-7-6-9(16)13-11(12-7)8-4-5-10(17-2)15-14-8/h4-6H,3H2,1-2H3,(H,12,13,16)
InChIKeyBFGZLRBXORUFEG-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.80
Rot. Bonds3

About 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one

4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one (PubChem CID 137012354) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one
PubChem CID137012354
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one
SMILESCCc1cc(=O)[nH]c(-c2ccc(OC)nn2)n1
InChIInChI=1S/C11H12N4O2/c1-3-7-6-9(16)13-11(12-7)8-4-5-10(17-2)15-14-8/h4-6H,3H2,1-2H3,(H,12,13,16)
InChIKeyBFGZLRBXORUFEG-UHFFFAOYSA-N
XLogP0.80
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-aminoethyl)-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one
CID 136790373
4-ethyl-5-iodo-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one
CID 136790340
4-ethyl-2-(4-fluoro-3-methoxyphenyl)-1H-pyrimidin-6-one
CID 136938663
2-(2-bromo-5-methoxyphenyl)-4-ethyl-1H-pyrimidin-6-one
CID 136774541
4-ethyl-2-[6-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]-3-pyridinyl]-1H-pyrimidin-6-one
CID 137256516
5-bromo-4-tert-butyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one
CID 136790337
4-ethyl-2-methyl-1H-pyrimidin-6-one;propane
CID 171619241
2-(3-chloro-4-hydroxyphenyl)-4-ethyl-1H-pyrimidin-6-one
CID 135974715
2-(3-bromo-2-pyridinyl)-4-ethyl-1H-pyrimidin-6-one
CID 136715411
2-(4-fluoro-3-methoxyphenyl)-4-propyl-1H-pyrimidin-6-one
CID 136889657
2-(4,5-dibromothiophen-2-yl)-4-ethyl-1H-pyrimidin-6-one
CID 136683043
4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one
CID 103347853

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one?
The IUPAC name of 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one (CID 137012354) is 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one?
The canonical SMILES for 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one is CCc1cc(=O)[nH]c(-c2ccc(OC)nn2)n1.
What is the InChIKey of 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one?
The InChIKey is BFGZLRBXORUFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-3-7-6-9(16)13-11(12-7)8-4-5-10(17-2)15-14-8/h4-6H,3H2,1-2H3,(H,12,13,16).
What are the key properties of 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one?
4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one has a molecular weight of 232.24 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(6-methoxypyridazin-3-yl)-1H-pyrimidin-6-one is sourced from PubChem (CID 137012354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).