4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one

C9H12N4O — CID 106952625

IUPAC4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one
SMILESCCC1N=C(c2cnn(C)c2)NC1=O
InChIInChI=1S/C9H12N4O/c1-3-7-9(14)12-8(11-7)6-4-10-13(2)5-6/h4-5,7H,3H2,1-2H3,(H,11,12,14)
InChIKeyRLJMKLGOLYMAES-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.08
Rot. Bonds2

About 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one

4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one (PubChem CID 106952625) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one
PubChem CID106952625
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one
SMILESCCC1N=C(c2cnn(C)c2)NC1=O
InChIInChI=1S/C9H12N4O/c1-3-7-9(14)12-8(11-7)6-4-10-13(2)5-6/h4-5,7H,3H2,1-2H3,(H,11,12,14)
InChIKeyRLJMKLGOLYMAES-UHFFFAOYSA-N
XLogP0.08
TPSA59.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-4-hydroxy-2-(1-methylpyrazol-4-yl)-1H-pyrimidin-6-one
CID 63611285
4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole
CID 82240877
4-ethyl-2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one
CID 106952774
6-ethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine-2,5-dione
CID 64879083
5-ethyl-4-(1-methylpyrazol-4-yl)-1H-pyrimidin-6-one
CID 136692282
4-cyclopentyl-1-methyl-5-(1-methylpyrazol-4-yl)pyridin-2-one
CID 135355394
4-cyclopropyl-2-(1-methylpyrazol-4-yl)-1H-pyrimidin-6-one
CID 135975402
4-methoxy-6-(1-methylpyrazol-4-yl)-1H-1,3,5-triazin-2-one
CID 106515838
5-ethyl-6-(1-methylpyrazol-4-yl)-4,5-dihydropyridazin-3-amine
CID 64691566
4-(4-ethylcyclohexen-1-yl)-1-methylpyrazole
CID 172782788
4-ethyl-3-(1-methylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione
CID 40585379
2,5-dimethyl-4-(1-methylpyrazol-4-yl)-1H-pyrazol-3-one
CID 165451138

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one (CID 106952625) is 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one is CCC1N=C(c2cnn(C)c2)NC1=O.
What is the InChIKey of 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one?
The InChIKey is RLJMKLGOLYMAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c1-3-7-9(14)12-8(11-7)6-4-10-13(2)5-6/h4-5,7H,3H2,1-2H3,(H,11,12,14).
What are the key properties of 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one?
4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one has a molecular weight of 192.22 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106952625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).