N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide

C24H29N3O5 — CID 70861165

IUPACN-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide
SMILESCOCCN(CC(=O)N1CC(=O)N(c2cccc(C)c2C)C1)C(=O)c1ccc(C)c(O)c1
InChIInChI=1S/C24H29N3O5/c1-16-6-5-7-20(18(16)3)27-15-26(14-23(27)30)22(29)13-25(10-11-32-4)24(31)19-9-8-17(2)21(28)12-19/h5-9,12,28H,10-11,13-15H2,1-4H3
InChIKeyAUTXMAQIBVDZME-UHFFFAOYSA-N
MW439.51 g/mol
LogP2.24
Rot. Bonds7

About N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide

N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide (PubChem CID 70861165) has the molecular formula C24H29N3O5 and a molecular weight of 439.51 g/mol. Its IUPAC name is N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide
PubChem CID70861165
Molecular FormulaC24H29N3O5
Molecular Weight439.51 g/mol
Exact Mass439.21
IUPAC NameN-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide
SMILESCOCCN(CC(=O)N1CC(=O)N(c2cccc(C)c2C)C1)C(=O)c1ccc(C)c(O)c1
InChIInChI=1S/C24H29N3O5/c1-16-6-5-7-20(18(16)3)27-15-26(14-23(27)30)22(29)13-25(10-11-32-4)24(31)19-9-8-17(2)21(28)12-19/h5-9,12,28H,10-11,13-15H2,1-4H3
InChIKeyAUTXMAQIBVDZME-UHFFFAOYSA-N
XLogP2.24
TPSA90.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.51
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide?
The IUPAC name of N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide (CID 70861165) is N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide.
What is the SMILES notation for N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide?
The canonical SMILES for N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide is COCCN(CC(=O)N1CC(=O)N(c2cccc(C)c2C)C1)C(=O)c1ccc(C)c(O)c1.
What is the InChIKey of N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide?
The InChIKey is AUTXMAQIBVDZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O5/c1-16-6-5-7-20(18(16)3)27-15-26(14-23(27)30)22(29)13-25(10-11-32-4)24(31)19-9-8-17(2)21(28)12-19/h5-9,12,28H,10-11,13-15H2,1-4H3.
What are the key properties of N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide?
N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide has a molecular weight of 439.51 g/mol, XLogP of 2.24, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide is sourced from PubChem (CID 70861165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).