5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one

C17H26N2O — CID 83243023

IUPAC5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one
SMILESCCCN1C(=O)C(Cc2ccccc2)NC1CC(C)C
InChIInChI=1S/C17H26N2O/c1-4-10-19-16(11-13(2)3)18-15(17(19)20)12-14-8-6-5-7-9-14/h5-9,13,15-16,18H,4,10-12H2,1-3H3
InChIKeyZWRZKMAMVHNLHW-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.81
Rot. Bonds6

About 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one

5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one (PubChem CID 83243023) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one
PubChem CID83243023
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one
SMILESCCCN1C(=O)C(Cc2ccccc2)NC1CC(C)C
InChIInChI=1S/C17H26N2O/c1-4-10-19-16(11-13(2)3)18-15(17(19)20)12-14-8-6-5-7-9-14/h5-9,13,15-16,18H,4,10-12H2,1-3H3
InChIKeyZWRZKMAMVHNLHW-UHFFFAOYSA-N
XLogP2.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.81
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
2-(2-methylpropyl)-3,5-dipropylimidazolidin-4-one
CID 83242530
2-(2-methylpropyl)-5-phenyl-3-propylimidazolidin-4-one
CID 83243033
5-benzyl-3-(2-cyclopropylethyl)-2-propylimidazolidin-4-one
CID 83268843
2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one
CID 114921936
5-benzyl-3-(cyclopropylmethyl)-2-propylimidazolidin-4-one
CID 83251332
5-benzyl-3-(3-ethoxypropyl)-2-ethylimidazolidin-4-one
CID 83232217
2-ethyl-3-(3-methylbutyl)-5-(2-phenylethyl)imidazolidin-4-one
CID 114921334
5-ethyl-2-(2-methylpropyl)-3-octylimidazolidin-4-one
CID 83260459
5-benzyl-3-pentan-3-yl-2-propylimidazolidin-4-one
CID 83246189
5-benzyl-3-hexyl-2-methylimidazolidin-4-one
CID 83263610
3-benzyl-1,6-bis(2-methylpropyl)piperazine-2,5-dione
CID 20676238

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one?
The IUPAC name of 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one (CID 83243023) is 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one.
What is the SMILES notation for 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one?
The canonical SMILES for 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one is CCCN1C(=O)C(Cc2ccccc2)NC1CC(C)C.
What is the InChIKey of 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one?
The InChIKey is ZWRZKMAMVHNLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-10-19-16(11-13(2)3)18-15(17(19)20)12-14-8-6-5-7-9-14/h5-9,13,15-16,18H,4,10-12H2,1-3H3.
What are the key properties of 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one?
5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one has a molecular weight of 274.41 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-2-(2-methylpropyl)-3-propylimidazolidin-4-one is sourced from PubChem (CID 83243023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).