2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one

C16H23N3O2 — CID 83247319

IUPAC2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2C2CCCN(C)C2)cc1
InChIInChI=1S/C16H23N3O2/c1-18-9-3-4-13(11-18)19-15(20)10-17-16(19)12-5-7-14(21-2)8-6-12/h5-8,13,16-17H,3-4,9-11H2,1-2H3
InChIKeyVOHHUOYRGYLLAD-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.22
Rot. Bonds3

About 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one

2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one (PubChem CID 83247319) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one
PubChem CID83247319
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2C2CCCN(C)C2)cc1
InChIInChI=1S/C16H23N3O2/c1-18-9-3-4-13(11-18)19-15(20)10-17-16(19)12-5-7-14(21-2)8-6-12/h5-8,13,16-17H,3-4,9-11H2,1-2H3
InChIKeyVOHHUOYRGYLLAD-UHFFFAOYSA-N
XLogP1.22
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one?
The IUPAC name of 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one (CID 83247319) is 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one.
What is the SMILES notation for 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one?
The canonical SMILES for 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one is COc1ccc(C2NCC(=O)N2C2CCCN(C)C2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one?
The InChIKey is VOHHUOYRGYLLAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-18-9-3-4-13(11-18)19-15(20)10-17-16(19)12-5-7-14(21-2)8-6-12/h5-8,13,16-17H,3-4,9-11H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one?
2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one has a molecular weight of 289.38 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-3-(1-methylpiperidin-3-yl)imidazolidin-4-one is sourced from PubChem (CID 83247319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).