5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one

C17H26N2O2 — CID 83237900

IUPAC5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one
SMILESCCCCC1NC(c2ccccc2)N(C(C)COC)C1=O
InChIInChI=1S/C17H26N2O2/c1-4-5-11-15-17(20)19(13(2)12-21-3)16(18-15)14-9-7-6-8-10-14/h6-10,13,15-16,18H,4-5,11-12H2,1-3H3
InChIKeyWBAHWOUGWUVGRN-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.71
Rot. Bonds7

About 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one

5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one (PubChem CID 83237900) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one
PubChem CID83237900
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one
SMILESCCCCC1NC(c2ccccc2)N(C(C)COC)C1=O
InChIInChI=1S/C17H26N2O2/c1-4-5-11-15-17(20)19(13(2)12-21-3)16(18-15)14-9-7-6-8-10-14/h6-10,13,15-16,18H,4-5,11-12H2,1-3H3
InChIKeyWBAHWOUGWUVGRN-UHFFFAOYSA-N
XLogP2.71
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methoxypropan-2-yl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83238139
3-pentan-2-yl-2-phenyl-5-propylimidazolidin-4-one
CID 83239646
5-butyl-3-(1-methoxypropan-2-yl)-2-propan-2-ylimidazolidin-4-one
CID 83239379
3-butan-2-yl-5-butyl-2-(4-fluorophenyl)imidazolidin-4-one
CID 83237076
5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one
CID 83240074
3-(1-methoxypropan-2-yl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83239793
3-(3-methoxy-2-methylpropyl)-2-phenyl-5-propylimidazolidin-4-one
CID 83252910
3,5-dibutyl-2-phenylimidazolidin-4-one
CID 83237789
5-butyl-3-(2,2-difluoroethyl)-2-phenylimidazolidin-4-one
CID 83270970
5-ethyl-3-(5-methylhexan-2-yl)-2-phenylimidazolidin-4-one
CID 83263251
3-(1-methoxypropan-2-yl)-2-methyl-5-(2-phenylethyl)imidazolidin-4-one
CID 114921482
5-butyl-3-(2,2-dimethylpropyl)-2-phenylimidazolidin-4-one
CID 83246817

Frequently Asked Questions

What is the IUPAC name of 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one?
The IUPAC name of 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one (CID 83237900) is 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one.
What is the SMILES notation for 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one?
The canonical SMILES for 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one is CCCCC1NC(c2ccccc2)N(C(C)COC)C1=O.
What is the InChIKey of 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one?
The InChIKey is WBAHWOUGWUVGRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-5-11-15-17(20)19(13(2)12-21-3)16(18-15)14-9-7-6-8-10-14/h6-10,13,15-16,18H,4-5,11-12H2,1-3H3.
What are the key properties of 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one?
5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one has a molecular weight of 290.41 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one is sourced from PubChem (CID 83237900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).