1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one

C25H33N3O2 — CID 138968161

IUPAC1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one
SMILESCC1(C)CCCC(C)(C)N1OCC1CN(c2ccccc2)C(=O)N1c1ccccc1
InChIInChI=1S/C25H33N3O2/c1-24(2)16-11-17-25(3,4)28(24)30-19-22-18-26(20-12-7-5-8-13-20)23(29)27(22)21-14-9-6-10-15-21/h5-10,12-15,22H,11,16-19H2,1-4H3
InChIKeyDTALSCRALXYNTE-UHFFFAOYSA-N
MW407.56 g/mol
LogP5.48
Rot. Bonds5

About 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one

1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one (PubChem CID 138968161) has the molecular formula C25H33N3O2 and a molecular weight of 407.56 g/mol. Its IUPAC name is 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one
PubChem CID138968161
Molecular FormulaC25H33N3O2
Molecular Weight407.56 g/mol
Exact Mass407.26
IUPAC Name1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one
SMILESCC1(C)CCCC(C)(C)N1OCC1CN(c2ccccc2)C(=O)N1c1ccccc1
InChIInChI=1S/C25H33N3O2/c1-24(2)16-11-17-25(3,4)28(24)30-19-22-18-26(20-12-7-5-8-13-20)23(29)27(22)21-14-9-6-10-15-21/h5-10,12-15,22H,11,16-19H2,1-4H3
InChIKeyDTALSCRALXYNTE-UHFFFAOYSA-N
XLogP5.48
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.56
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one?
The IUPAC name of 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one (CID 138968161) is 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one.
What is the SMILES notation for 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one?
The canonical SMILES for 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one is CC1(C)CCCC(C)(C)N1OCC1CN(c2ccccc2)C(=O)N1c1ccccc1.
What is the InChIKey of 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one?
The InChIKey is DTALSCRALXYNTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N3O2/c1-24(2)16-11-17-25(3,4)28(24)30-19-22-18-26(20-12-7-5-8-13-20)23(29)27(22)21-14-9-6-10-15-21/h5-10,12-15,22H,11,16-19H2,1-4H3.
What are the key properties of 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one?
1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one has a molecular weight of 407.56 g/mol, XLogP of 5.48, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diphenyl-4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]imidazolidin-2-one is sourced from PubChem (CID 138968161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).