2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one

C12H14N2O2 — CID 106952206

IUPAC2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one
SMILESCOc1ccccc1CC1=NC(C)C(=O)N1
InChIInChI=1S/C12H14N2O2/c1-8-12(15)14-11(13-8)7-9-5-3-4-6-10(9)16-2/h3-6,8H,7H2,1-2H3,(H,13,14,15)
InChIKeySBXWJHZJVJIHMX-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.15
Rot. Bonds3

About 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one

2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one (PubChem CID 106952206) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one
PubChem CID106952206
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one
SMILESCOc1ccccc1CC1=NC(C)C(=O)N1
InChIInChI=1S/C12H14N2O2/c1-8-12(15)14-11(13-8)7-9-5-3-4-6-10(9)16-2/h3-6,8H,7H2,1-2H3,(H,13,14,15)
InChIKeySBXWJHZJVJIHMX-UHFFFAOYSA-N
XLogP1.15
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4R,5S)-2-[(2-methoxyphenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 68568247
2-[(3,5-dimethylphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one
CID 106952008
2-[(2-methoxyphenyl)methyl]-1H-pyrimidin-6-one
CID 61263830
2-[(2-methoxyphenyl)methyl]-4,5-dimethyl-1H-pyrimidin-6-one
CID 135973576
4-[(2-methoxyphenyl)methyl]-2-oxo-1H-pyridine-3-carbonitrile
CID 70494743
[2-[(2-methoxyphenyl)methyl]phenyl]methylphosphane
CID 69335207
1-bromo-2-[(2-methoxyphenyl)methyl]benzene
CID 165410095
2-(4-hydroxy-3-methoxyphenyl)-4-methyl-1,4-dihydroimidazol-5-one
CID 136827204
2-(4-methoxy-3-methylphenyl)-4-methyl-1,4-dihydroimidazol-5-one
CID 106952061
4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
CID 23009519
azanium 5-[(2-methoxyphenyl)methyl]-2,4-dioxo-1H-pyrimidin-6-olate
CID 44660539
3-[(2-methoxyphenyl)methyl]piperidin-2-one
CID 104679153

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one (CID 106952206) is 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one is COc1ccccc1CC1=NC(C)C(=O)N1.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one?
The InChIKey is SBXWJHZJVJIHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8-12(15)14-11(13-8)7-9-5-3-4-6-10(9)16-2/h3-6,8H,7H2,1-2H3,(H,13,14,15).
What are the key properties of 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one?
2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one has a molecular weight of 218.26 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl]-4-methyl-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106952206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).