4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one

C8H12N2O — CID 163837151

IUPAC4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one
SMILESC=C(C)C1=NC(CC)C(=O)N1
InChIInChI=1S/C8H12N2O/c1-4-6-8(11)10-7(9-6)5(2)3/h6H,2,4H2,1,3H3,(H,9,10,11)
InChIKeyOITAVNGGGOYZDA-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.87
Rot. Bonds2

About 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one

4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one (PubChem CID 163837151) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one
PubChem CID163837151
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one
SMILESC=C(C)C1=NC(CC)C(=O)N1
InChIInChI=1S/C8H12N2O/c1-4-6-8(11)10-7(9-6)5(2)3/h6H,2,4H2,1,3H3,(H,9,10,11)
InChIKeyOITAVNGGGOYZDA-UHFFFAOYSA-N
XLogP0.87
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one
CID 106952774
4-ethyl-2-(2,2,2-trifluoroethyl)-1,4-dihydroimidazol-5-one
CID 106952587
4-ethyl-2-(methylsulfonylmethyl)-1,4-dihydroimidazol-5-one
CID 106952590
4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one
CID 106952766
2-(4-bromothiophen-2-yl)-4-ethyl-1,4-dihydroimidazol-5-one
CID 106952623
2-(2-ethoxybutan-2-yl)-4-ethyl-1,4-dihydroimidazol-5-one
CID 106952604
2-[(4-chlorophenyl)methyl]-4-ethyl-1,4-dihydroimidazol-5-one
CID 106952576
4-ethyl-2-(3-methylimidazol-4-yl)-1,4-dihydroimidazol-5-one
CID 106952715
4-ethyl-2-(1-methylpyrazol-4-yl)-1,4-dihydroimidazol-5-one
CID 106952625
2-(5,6-dimethyl-1,4-dithian-2-yl)-4-ethyl-1,4-dihydroimidazol-5-one
CID 106952573
4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one
CID 106952595
4-ethyl-2-(pyridin-2-ylmethyl)-1,4-dihydroimidazol-5-one
CID 106952692

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one?
The IUPAC name of 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one (CID 163837151) is 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one?
The canonical SMILES for 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one is C=C(C)C1=NC(CC)C(=O)N1.
What is the InChIKey of 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one?
The InChIKey is OITAVNGGGOYZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-4-6-8(11)10-7(9-6)5(2)3/h6H,2,4H2,1,3H3,(H,9,10,11).
What are the key properties of 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one?
4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one has a molecular weight of 152.20 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 163837151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).