4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one

C9H10N4O — CID 106952595

IUPAC4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one
SMILESCCC1N=C(c2ccncn2)NC1=O
InChIInChI=1S/C9H10N4O/c1-2-6-9(14)13-8(12-6)7-3-4-10-5-11-7/h3-6H,2H2,1H3,(H,12,13,14)
InChIKeyXGHXVPRPNITJPM-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.13
Rot. Bonds2

About 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one

4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one (PubChem CID 106952595) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one
PubChem CID106952595
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one
SMILESCCC1N=C(c2ccncn2)NC1=O
InChIInChI=1S/C9H10N4O/c1-2-6-9(14)13-8(12-6)7-3-4-10-5-11-7/h3-6H,2H2,1H3,(H,12,13,14)
InChIKeyXGHXVPRPNITJPM-UHFFFAOYSA-N
XLogP0.13
TPSA67.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Acetoacetamido-4-methylpyrimidine
CID 573260
N'-cyclopentyl-N-methyl-N-(4-pyrimidinylmethyl)succinamide
CID 28363197
5-Ethyl-3-(2-piperazin-1-ylpyrimidin-4-yl)-1,2,4-oxadiazole
CID 45588217
5-Methyl-3-(2-piperazin-1-ylpyrimidin-4-yl)-1,2,4-oxadiazole
CID 45588452
1-[2-(4-Methylpyrimidin-2-yl)pyrrolidin-1-yl]ethanone
CID 73439401
2-(Dimethylamino)-1-[2-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]ethanone
CID 73440182
3-Ethyl-4-(6-methylpyrimidin-4-yl)piperazin-2-one
CID 75379309
3-Ethyl-4-(4-methylpyrimidin-2-yl)piperazin-2-one
CID 75379310
1-[[2-(Dimethylamino)pyrimidin-4-yl]methyl]-3-propan-2-ylurea
CID 75444256
1-Tert-butyl-3-[[2-(dimethylamino)pyrimidin-4-yl]methyl]urea
CID 75444258
1-[[2-(Dimethylamino)pyrimidin-4-yl]methyl]-3-ethylurea
CID 75444259
1-[2-(4-Methylpyrimidin-2-yl)piperidin-1-yl]butan-1-one
CID 110256003

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one?
The IUPAC name of 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one (CID 106952595) is 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one?
The canonical SMILES for 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one is CCC1N=C(c2ccncn2)NC1=O.
What is the InChIKey of 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one?
The InChIKey is XGHXVPRPNITJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-2-6-9(14)13-8(12-6)7-3-4-10-5-11-7/h3-6H,2H2,1H3,(H,12,13,14).
What are the key properties of 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one?
4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one has a molecular weight of 190.21 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-pyrimidin-4-yl-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106952595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).