5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one

C16H24N2O — CID 115282125

IUPAC5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one
SMILESCCCN1C(=O)C(C)NC1c1ccc(C(C)C)cc1
InChIInChI=1S/C16H24N2O/c1-5-10-18-15(17-12(4)16(18)19)14-8-6-13(7-9-14)11(2)3/h6-9,11-12,15,17H,5,10H2,1-4H3
InChIKeyXCRAHRAMEBWQBK-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.04
Rot. Bonds4

About 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one

5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one (PubChem CID 115282125) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one
PubChem CID115282125
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one
SMILESCCCN1C(=O)C(C)NC1c1ccc(C(C)C)cc1
InChIInChI=1S/C16H24N2O/c1-5-10-18-15(17-12(4)16(18)19)14-8-6-13(7-9-14)11(2)3/h6-9,11-12,15,17H,5,10H2,1-4H3
InChIKeyXCRAHRAMEBWQBK-UHFFFAOYSA-N
XLogP3.04
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-5-methyl-2-(4-propan-2-ylphenyl)imidazolidin-4-one
CID 115282163
2-(4-fluorophenyl)-5-methyl-3-propylimidazolidin-4-one
CID 115282121
2-(4-ethylphenyl)-5-methyl-3-(3-methylbutyl)imidazolidin-4-one
CID 83237437
3-butyl-2-(4-tert-butylphenyl)-5-methylimidazolidin-4-one
CID 83238348
5-methyl-3-(3-methylbutyl)-2-phenylimidazolidin-4-one
CID 83237421
5-methyl-3-pentyl-2-phenylimidazolidin-4-one
CID 83250974
2-(4-chlorophenyl)-3-(2-ethoxyethyl)-5-methylimidazolidin-4-one
CID 83236742
5-(4-propan-2-ylphenyl)-6-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83241982
5-butan-2-yl-2-(4-chlorophenyl)-3-propylimidazolidin-4-one
CID 83242766
2-(4-methoxyphenyl)-5-methyl-3-pentylimidazolidin-4-one
CID 83250631
5-methyl-2-(4-methylphenyl)-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 114983327
3-(2-ethoxyethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83236973

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one?
The IUPAC name of 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one (CID 115282125) is 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one.
What is the SMILES notation for 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one?
The canonical SMILES for 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one is CCCN1C(=O)C(C)NC1c1ccc(C(C)C)cc1.
What is the InChIKey of 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one?
The InChIKey is XCRAHRAMEBWQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-5-10-18-15(17-12(4)16(18)19)14-8-6-13(7-9-14)11(2)3/h6-9,11-12,15,17H,5,10H2,1-4H3.
What are the key properties of 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one?
5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one has a molecular weight of 260.38 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one is sourced from PubChem (CID 115282125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).