3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one

C16H24N2O2 — CID 114921482

IUPAC3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
SMILESCOCC(C)N1C(=O)C(CCc2ccccc2)NC1C
InChIInChI=1S/C16H24N2O2/c1-12(11-20-3)18-13(2)17-15(16(18)19)10-9-14-7-5-4-6-8-14/h4-8,12-13,15,17H,9-11H2,1-3H3
InChIKeyAPVRBOUCSWOWOF-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.80
Rot. Bonds6

About 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one

3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one (PubChem CID 114921482) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
PubChem CID114921482
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
SMILESCOCC(C)N1C(=O)C(CCc2ccccc2)NC1C
InChIInChI=1S/C16H24N2O2/c1-12(11-20-3)18-13(2)17-15(16(18)19)10-9-14-7-5-4-6-8-14/h4-8,12-13,15,17H,9-11H2,1-3H3
InChIKeyAPVRBOUCSWOWOF-UHFFFAOYSA-N
XLogP1.80
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-(1-methylsulfanylpropan-2-yl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114929249
3-(1-methoxypropan-2-yl)-2-methyl-5-propylimidazolidin-4-one
CID 83240070
2-methyl-5-(2-phenylethyl)-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 114928963
5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one
CID 83237900
3-(2-cyclopropylpropyl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114929268
5-benzyl-3-hexan-2-yl-2-methylimidazolidin-4-one
CID 83253722
3-(1-methoxypropan-2-yl)-2,5-dipropylimidazolidin-4-one
CID 83238801
3-hexyl-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114926561
2-ethyl-3-(2-methylpropyl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114921798
3-(1-methoxypropan-2-yl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83239793
3-(1-methoxypropan-2-yl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83238139
5-benzyl-3-(1-methoxypropan-2-yl)imidazolidin-4-one
CID 83239712

Frequently Asked Questions

What is the IUPAC name of 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one?
The IUPAC name of 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one (CID 114921482) is 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one.
What is the SMILES notation for 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one?
The canonical SMILES for 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one is COCC(C)N1C(=O)C(CCc2ccccc2)NC1C.
What is the InChIKey of 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one?
The InChIKey is APVRBOUCSWOWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(11-20-3)18-13(2)17-15(16(18)19)10-9-14-7-5-4-6-8-14/h4-8,12-13,15,17H,9-11H2,1-3H3.
What are the key properties of 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one?
3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one has a molecular weight of 276.38 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one is sourced from PubChem (CID 114921482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).