3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one

C15H20N2O2 — CID 83256657

IUPAC3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one
SMILESO=C1CNC(c2ccccc2)N1CC1CCCCO1
InChIInChI=1S/C15H20N2O2/c18-14-10-16-15(12-6-2-1-3-7-12)17(14)11-13-8-4-5-9-19-13/h1-3,6-7,13,15-16H,4-5,8-11H2
InChIKeyUWNMDPDKRMXVAK-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.69
Rot. Bonds3

About 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one

3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one (PubChem CID 83256657) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one.

Molecular Properties

Compound Name3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one
PubChem CID83256657
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one
SMILESO=C1CNC(c2ccccc2)N1CC1CCCCO1
InChIInChI=1S/C15H20N2O2/c18-14-10-16-15(12-6-2-1-3-7-12)17(14)11-13-8-4-5-9-19-13/h1-3,6-7,13,15-16H,4-5,8-11H2
InChIKeyUWNMDPDKRMXVAK-UHFFFAOYSA-N
XLogP1.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylmethyl)-2-phenylimidazolidin-4-one
CID 83250909
2-ethyl-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83256573
3-[(3-methylcyclopentyl)methyl]-2-phenylimidazolidin-4-one
CID 107416096
3-[(1-ethylpyrrolidin-2-yl)methyl]-2-phenylimidazolidin-4-one
CID 83250520
2-(3-methoxyphenyl)-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83253145
3-(oxan-2-ylmethyl)-5,5-diphenylimidazolidine-2,4-dione
CID 43000639
2-(2-fluorophenyl)-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83249203
2-(3-fluorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one
CID 83269076
2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one
CID 83268879
3-(oxan-2-ylmethyl)imidazolidine-2,4-dione
CID 103601172
2-phenyl-3-(2-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83270706
(4E,5R)-4-[hydroxy(phenyl)methylidene]-1-[[(2R)-oxolan-2-yl]methyl]-5-phenylpyrrolidine-2,3-dione
CID 5442833

Frequently Asked Questions

What is the IUPAC name of 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one?
The IUPAC name of 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one (CID 83256657) is 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one.
What is the SMILES notation for 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one?
The canonical SMILES for 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one is O=C1CNC(c2ccccc2)N1CC1CCCCO1.
What is the InChIKey of 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one?
The InChIKey is UWNMDPDKRMXVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-14-10-16-15(12-6-2-1-3-7-12)17(14)11-13-8-4-5-9-19-13/h1-3,6-7,13,15-16H,4-5,8-11H2.
What are the key properties of 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one?
3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one has a molecular weight of 260.34 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxan-2-ylmethyl)-2-phenylimidazolidin-4-one is sourced from PubChem (CID 83256657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).