3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one

C17H26N2O2 — CID 114983375

IUPAC3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one
SMILESCOC(C)(C)CN1C(=O)CNC1c1ccc(C(C)C)cc1
InChIInChI=1S/C17H26N2O2/c1-12(2)13-6-8-14(9-7-13)16-18-10-15(20)19(16)11-17(3,4)21-5/h6-9,12,16,18H,10-11H2,1-5H3
InChIKeyXFEUCJKLZMHJMQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.67
Rot. Bonds5

About 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one

3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one (PubChem CID 114983375) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one
PubChem CID114983375
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one
SMILESCOC(C)(C)CN1C(=O)CNC1c1ccc(C(C)C)cc1
InChIInChI=1S/C17H26N2O2/c1-12(2)13-6-8-14(9-7-13)16-18-10-15(20)19(16)11-17(3,4)21-5/h6-9,12,16,18H,10-11H2,1-5H3
InChIKeyXFEUCJKLZMHJMQ-UHFFFAOYSA-N
XLogP2.67
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one?
The IUPAC name of 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one (CID 114983375) is 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one.
What is the SMILES notation for 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one?
The canonical SMILES for 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one is COC(C)(C)CN1C(=O)CNC1c1ccc(C(C)C)cc1.
What is the InChIKey of 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one?
The InChIKey is XFEUCJKLZMHJMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12(2)13-6-8-14(9-7-13)16-18-10-15(20)19(16)11-17(3,4)21-5/h6-9,12,16,18H,10-11H2,1-5H3.
What are the key properties of 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one?
3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one has a molecular weight of 290.41 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-2-methylpropyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one is sourced from PubChem (CID 114983375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).