5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one

C12H15N3O2 — CID 79967269

IUPAC5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one
SMILESCCN1C(=O)N=C(N)C1c1ccccc1OC
InChIInChI=1S/C12H15N3O2/c1-3-15-10(11(13)14-12(15)16)8-6-4-5-7-9(8)17-2/h4-7,10H,3H2,1-2H3,(H2,13,14,16)
InChIKeyGCLPIWXYMNWYFA-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.55
Rot. Bonds3

About 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one

5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one (PubChem CID 79967269) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one
PubChem CID79967269
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one
SMILESCCN1C(=O)N=C(N)C1c1ccccc1OC
InChIInChI=1S/C12H15N3O2/c1-3-15-10(11(13)14-12(15)16)8-6-4-5-7-9(8)17-2/h4-7,10H,3H2,1-2H3,(H2,13,14,16)
InChIKeyGCLPIWXYMNWYFA-UHFFFAOYSA-N
XLogP1.55
TPSA67.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-3-ethyl-4-naphthalen-1-yl-4H-imidazol-2-one
CID 79961258
5-amino-4-(2-bromo-4-methoxyphenyl)-3-ethyl-4H-imidazol-2-one
CID 112749216
5-amino-3-but-3-yn-2-yl-4-(2-methoxyphenyl)-4H-imidazol-2-one
CID 114420923
5-amino-3-ethyl-4-isoquinolin-4-yl-4H-imidazol-2-one
CID 104505449
5-amino-4-(1,3-dimethylpyrazol-4-yl)-3-ethyl-4H-imidazol-2-one
CID 83095040
5-amino-4-(2,3-dimethoxyphenyl)-3-methyl-4H-imidazol-2-one
CID 79959271
5-amino-3-ethyl-4-(6-methoxy-3-pyridinyl)-4H-imidazol-2-one
CID 114939050
5-amino-3-(cyclopropylmethyl)-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one
CID 79971673
5-amino-4-[2-(difluoromethoxy)phenyl]-3-prop-2-ynyl-4H-imidazol-2-one
CID 79968099
1-ethyl-4-(2-methoxyphenyl)-3,3-dimethylazetidin-2-one
CID 90667223
5-amino-3-ethyl-4-[4-(trifluoromethyl)phenyl]-4H-imidazol-2-one
CID 79967736
5-amino-4-[4-(difluoromethyl)phenyl]-3-ethyl-4H-imidazol-2-one
CID 113328663

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one?
The IUPAC name of 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one (CID 79967269) is 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one?
The canonical SMILES for 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one is CCN1C(=O)N=C(N)C1c1ccccc1OC.
What is the InChIKey of 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one?
The InChIKey is GCLPIWXYMNWYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-3-15-10(11(13)14-12(15)16)8-6-4-5-7-9(8)17-2/h4-7,10H,3H2,1-2H3,(H2,13,14,16).
What are the key properties of 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one?
5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one has a molecular weight of 233.27 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-ethyl-4-(2-methoxyphenyl)-4H-imidazol-2-one is sourced from PubChem (CID 79967269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).