1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one

C15H22N2O — CID 116983004

IUPAC1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one
SMILESCCN1CC(c2ccc(C(C)C)cc2)N(C)C1=O
InChIInChI=1S/C15H22N2O/c1-5-17-10-14(16(4)15(17)18)13-8-6-12(7-9-13)11(2)3/h6-9,11,14H,5,10H2,1-4H3
InChIKeyGCVSSISBIJQJKB-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.24
Rot. Bonds3

About 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one

1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one (PubChem CID 116983004) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one
PubChem CID116983004
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one
SMILESCCN1CC(c2ccc(C(C)C)cc2)N(C)C1=O
InChIInChI=1S/C15H22N2O/c1-5-17-10-14(16(4)15(17)18)13-8-6-12(7-9-13)11(2)3/h6-9,11,14H,5,10H2,1-4H3
InChIKeyGCVSSISBIJQJKB-UHFFFAOYSA-N
XLogP3.24
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one?
The IUPAC name of 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one (CID 116983004) is 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one?
The canonical SMILES for 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one is CCN1CC(c2ccc(C(C)C)cc2)N(C)C1=O.
What is the InChIKey of 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one?
The InChIKey is GCVSSISBIJQJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-5-17-10-14(16(4)15(17)18)13-8-6-12(7-9-13)11(2)3/h6-9,11,14H,5,10H2,1-4H3.
What are the key properties of 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one?
1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one has a molecular weight of 246.35 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-4-(4-propan-2-ylphenyl)imidazolidin-2-one is sourced from PubChem (CID 116983004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).