2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one

C10H12N4O2 — CID 114556573

IUPAC2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
SMILESCCn1nccc1-c1nc(O)c(C)c(=O)[nH]1
InChIInChI=1S/C10H12N4O2/c1-3-14-7(4-5-11-14)8-12-9(15)6(2)10(16)13-8/h4-5H,3H2,1-2H3,(H2,12,13,15,16)
InChIKeyFVBPSCKUQBLQSG-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.67
Rot. Bonds2

About 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one

2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one (PubChem CID 114556573) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
PubChem CID114556573
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
SMILESCCn1nccc1-c1nc(O)c(C)c(=O)[nH]1
InChIInChI=1S/C10H12N4O2/c1-3-14-7(4-5-11-14)8-12-9(15)6(2)10(16)13-8/h4-5H,3H2,1-2H3,(H2,12,13,15,16)
InChIKeyFVBPSCKUQBLQSG-UHFFFAOYSA-N
XLogP0.67
TPSA83.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethylpyrazol-3-yl)-5-iodo-4-methyl-1H-pyrimidin-6-one
CID 137005366
2-(2-ethylpyrazol-3-yl)-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one
CID 137015390
5-bromo-2-(2-ethylpyrazol-3-yl)-4-(methoxymethyl)-1H-pyrimidin-6-one
CID 137005380
2-(4-ethylphenyl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
CID 63611424
4-hydroxy-5-(4-methylphenyl)-2-(2-methylpyrazol-3-yl)-1H-pyrimidin-6-one
CID 114553938
5-(2-hydroxyethyl)-4-methyl-2-(2-propylpyrazol-3-yl)-1H-pyrimidin-6-one
CID 137005359
4-hydroxy-5-methyl-2-(2-methylphenyl)-1H-pyrimidin-6-one
CID 63612440
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one
CID 118164228
4-hydroxy-5-methyl-2-(4-propoxyphenyl)-1H-pyrimidin-6-one
CID 46734906
4-hydroxy-5-methyl-2-(5-methyl-2-pyridinyl)-1H-pyrimidin-6-one
CID 81313246
[2-(2-ethylpyrazol-3-yl)-1H-imidazol-5-yl]methanol
CID 137005410
5-(2-hydroxyethyl)-4-methyl-2-(2-methylpyrazol-3-yl)-1H-pyrimidin-6-one
CID 137005311

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one?
The IUPAC name of 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one (CID 114556573) is 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one is CCn1nccc1-c1nc(O)c(C)c(=O)[nH]1.
What is the InChIKey of 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one?
The InChIKey is FVBPSCKUQBLQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-3-14-7(4-5-11-14)8-12-9(15)6(2)10(16)13-8/h4-5H,3H2,1-2H3,(H2,12,13,15,16).
What are the key properties of 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one?
2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one has a molecular weight of 220.23 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpyrazol-3-yl)-4-hydroxy-5-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 114556573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).