2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one

C16H24N2O — CID 114921936

IUPAC2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one
SMILESCCCN1C(=O)C(CCc2ccccc2)NC1CC
InChIInChI=1S/C16H24N2O/c1-3-12-18-15(4-2)17-14(16(18)19)11-10-13-8-6-5-7-9-13/h5-9,14-15,17H,3-4,10-12H2,1-2H3
InChIKeyQNMBKOWBBZZMON-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.57
Rot. Bonds6

About 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one

2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one (PubChem CID 114921936) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one.

Molecular Properties

Compound Name2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one
PubChem CID114921936
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one
SMILESCCCN1C(=O)C(CCc2ccccc2)NC1CC
InChIInChI=1S/C16H24N2O/c1-3-12-18-15(4-2)17-14(16(18)19)11-10-13-8-6-5-7-9-13/h5-9,14-15,17H,3-4,10-12H2,1-2H3
InChIKeyQNMBKOWBBZZMON-UHFFFAOYSA-N
XLogP2.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one?
The IUPAC name of 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one (CID 114921936) is 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one.
What is the SMILES notation for 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one?
The canonical SMILES for 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one is CCCN1C(=O)C(CCc2ccccc2)NC1CC.
What is the InChIKey of 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one?
The InChIKey is QNMBKOWBBZZMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-12-18-15(4-2)17-14(16(18)19)11-10-13-8-6-5-7-9-13/h5-9,14-15,17H,3-4,10-12H2,1-2H3.
What are the key properties of 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one?
2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one has a molecular weight of 260.38 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-(2-phenylethyl)-3-propylimidazolidin-4-one is sourced from PubChem (CID 114921936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).