1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one

C16H16N2O2 — CID 116980839

IUPAC1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one
SMILESCN1CC(c2ccc(Oc3ccccc3)cc2)NC1=O
InChIInChI=1S/C16H16N2O2/c1-18-11-15(17-16(18)19)12-7-9-14(10-8-12)20-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3,(H,17,19)
InChIKeyHKRQASMRNICQLO-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.17
Rot. Bonds3

About 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one

1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one (PubChem CID 116980839) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one
PubChem CID116980839
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one
SMILESCN1CC(c2ccc(Oc3ccccc3)cc2)NC1=O
InChIInChI=1S/C16H16N2O2/c1-18-11-15(17-16(18)19)12-7-9-14(10-8-12)20-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3,(H,17,19)
InChIKeyHKRQASMRNICQLO-UHFFFAOYSA-N
XLogP3.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-pyridin-4-ylimidazolidin-2-one
CID 90179114
ethane;1-methyl-4-pyridin-4-ylimidazolidin-2-one
CID 143177122
(4R)-4-(4-phenoxyphenyl)-1,3-oxazolidin-2-one
CID 171184568
4-(3,4-dihydroxyphenyl)-1-methylimidazolidin-2-one
CID 24973439
4-(4-butan-2-ylphenyl)-1-methylimidazolidin-2-one
CID 116980818
(4R)-4-(4-phenoxyphenyl)-1,3-oxazinan-2-one;hydrochloride
CID 171185191
(4S)-N,1-dimethyl-2-oxo-N-[(4-phenoxyphenyl)methyl]imidazolidine-4-carboxamide
CID 95862292
2-(1-methyl-2-oxoimidazolidin-4-yl)benzoic acid
CID 105475250
4-(2,3-dihydro-1H-inden-5-yl)-1-methylimidazolidin-2-one
CID 116980815
1-methyl-5-(4-phenoxyphenyl)-1,3-diazinane-2,4,6-trione
CID 141055263
(4S)-1,4-diphenylimidazolidin-2-one
CID 163207794
1-methyl-4-[3-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 90179148

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one?
The IUPAC name of 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one (CID 116980839) is 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one?
The canonical SMILES for 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one is CN1CC(c2ccc(Oc3ccccc3)cc2)NC1=O.
What is the InChIKey of 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one?
The InChIKey is HKRQASMRNICQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-18-11-15(17-16(18)19)12-7-9-14(10-8-12)20-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3,(H,17,19).
What are the key properties of 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one?
1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one has a molecular weight of 268.32 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one is sourced from PubChem (CID 116980839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).