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

C9H16N2O2 — CID 106952766

IUPAC4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one
SMILESCCC1N=C(C(C)(C)OC)NC1=O
InChIInChI=1S/C9H16N2O2/c1-5-6-7(12)11-8(10-6)9(2,3)13-4/h6H,5H2,1-4H3,(H,10,11,12)
InChIKeyMYLBNAOLZNHGKN-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.72
Rot. Bonds3

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

4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one (PubChem CID 106952766) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one
PubChem CID106952766
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one
SMILESCCC1N=C(C(C)(C)OC)NC1=O
InChIInChI=1S/C9H16N2O2/c1-5-6-7(12)11-8(10-6)9(2,3)13-4/h6H,5H2,1-4H3,(H,10,11,12)
InChIKeyMYLBNAOLZNHGKN-UHFFFAOYSA-N
XLogP0.72
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethoxybutan-2-yl)-4-ethyl-1,4-dihydroimidazol-5-one
CID 106952604
2-(3-methoxypentan-3-yl)-4-propyl-1,4-dihydroimidazol-5-one
CID 106952802
2-tert-butyl-4-propyl-1,4-dihydroimidazol-5-one
CID 106952812
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
2-(2-methoxybutan-2-yl)-4-propan-2-yl-1,4-dihydroimidazol-5-one
CID 106953207
2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one
CID 106676684
4-ethyl-2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one
CID 106952774
4-ethyl-2-prop-1-en-2-yl-1,4-dihydroimidazol-5-one
CID 163837151
(5R)-5-ethyl-3-methoxy-2,5-dihydro-1H-pyrazin-6-one
CID 142558595
4-ethyl-2-(4-methoxyoxan-4-yl)-1,4-dihydroimidazol-5-one
CID 106952717
CID 136888542
CID 136888542

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one (CID 106952766) is 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one is CCC1N=C(C(C)(C)OC)NC1=O.
What is the InChIKey of 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one?
The InChIKey is MYLBNAOLZNHGKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-5-6-7(12)11-8(10-6)9(2,3)13-4/h6H,5H2,1-4H3,(H,10,11,12).
What are the key properties of 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one?
4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one has a molecular weight of 184.24 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106952766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).