5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one

C18H26N2O — CID 83244903

IUPAC5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one
SMILESCCCCC1NC(c2ccc(CC)cc2)N(C2CC2)C1=O
InChIInChI=1S/C18H26N2O/c1-3-5-6-16-18(21)20(15-11-12-15)17(19-16)14-9-7-13(4-2)8-10-14/h7-10,15-17,19H,3-6,11-12H2,1-2H3
InChIKeyMVUJUOASBVDPKY-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.40
Rot. Bonds6

About 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one

5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one (PubChem CID 83244903) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one
PubChem CID83244903
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one
SMILESCCCCC1NC(c2ccc(CC)cc2)N(C2CC2)C1=O
InChIInChI=1S/C18H26N2O/c1-3-5-6-16-18(21)20(15-11-12-15)17(19-16)14-9-7-13(4-2)8-10-14/h7-10,15-17,19H,3-6,11-12H2,1-2H3
InChIKeyMVUJUOASBVDPKY-UHFFFAOYSA-N
XLogP3.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one?
The IUPAC name of 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one (CID 83244903) is 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one.
What is the SMILES notation for 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one?
The canonical SMILES for 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one is CCCCC1NC(c2ccc(CC)cc2)N(C2CC2)C1=O.
What is the InChIKey of 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one?
The InChIKey is MVUJUOASBVDPKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-3-5-6-16-18(21)20(15-11-12-15)17(19-16)14-9-7-13(4-2)8-10-14/h7-10,15-17,19H,3-6,11-12H2,1-2H3.
What are the key properties of 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one?
5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one has a molecular weight of 286.42 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one is sourced from PubChem (CID 83244903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).