5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one

C18H28N2O — CID 83246189

IUPAC5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one
SMILESCCCC1NC(Cc2ccccc2)C(=O)N1C(CC)CC
InChIInChI=1S/C18H28N2O/c1-4-10-17-19-16(13-14-11-8-7-9-12-14)18(21)20(17)15(5-2)6-3/h7-9,11-12,15-17,19H,4-6,10,13H2,1-3H3
InChIKeyWIZFDMQECNBQEA-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.34
Rot. Bonds7

About 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one

5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one (PubChem CID 83246189) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one
PubChem CID83246189
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one
SMILESCCCC1NC(Cc2ccccc2)C(=O)N1C(CC)CC
InChIInChI=1S/C18H28N2O/c1-4-10-17-19-16(13-14-11-8-7-9-12-14)18(21)20(17)15(5-2)6-3/h7-9,11-12,15-17,19H,4-6,10,13H2,1-3H3
InChIKeyWIZFDMQECNBQEA-UHFFFAOYSA-N
XLogP3.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-benzyl-3-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83242743
5-benzyl-3-(cyclopropylmethyl)-2-propylimidazolidin-4-one
CID 83251332
5-benzyl-3-cyclobutyl-2-propylimidazolidin-4-one
CID 83255145
5-benzyl-3-(2-cyclopropylethyl)-2-propylimidazolidin-4-one
CID 83268843
5-benzyl-3-butan-2-yl-2-propan-2-ylimidazolidin-4-one
CID 83239760
5-butan-2-yl-3-pentan-3-yl-2-propylimidazolidin-4-one
CID 83241971
2-(2-methylpropyl)-3-pentan-3-yl-5-propylimidazolidin-4-one
CID 83242841
(2S)-2-[[(2S)-2-[(4S)-4-[(4-hydroxyphenyl)methyl]-5-oxo-2-propylimidazolidin-1-yl]propanoyl]amino]-3-phenylpropanamide
CID 101160617
5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one
CID 83243023
(2R,5S)-2,5-dibenzyl-3-hydroxyimidazolidin-4-one
CID 59883976
5-benzyl-3-hexan-2-yl-2-methylimidazolidin-4-one
CID 83253722
5-benzyl-3-cyclopropyl-2-ethylimidazolidin-4-one
CID 83242720

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one?
The IUPAC name of 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one (CID 83246189) is 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one.
What is the SMILES notation for 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one?
The canonical SMILES for 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one is CCCC1NC(Cc2ccccc2)C(=O)N1C(CC)CC.
What is the InChIKey of 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one?
The InChIKey is WIZFDMQECNBQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-10-17-19-16(13-14-11-8-7-9-12-14)18(21)20(17)15(5-2)6-3/h7-9,11-12,15-17,19H,4-6,10,13H2,1-3H3.
What are the key properties of 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one?
5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one has a molecular weight of 288.43 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one is sourced from PubChem (CID 83246189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).