N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide

C21H25N3O4S — CID 24718563

IUPACN-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide
SMILESCOc1ccc(N2CN(C(=O)CN(CC(C)C)C(=O)c3cccs3)CC2=O)cc1
InChIInChI=1S/C21H25N3O4S/c1-15(2)11-22(21(27)18-5-4-10-29-18)12-19(25)23-13-20(26)24(14-23)16-6-8-17(28-3)9-7-16/h4-10,15H,11-14H2,1-3H3
InChIKeyIYSUWUDGWYHYRR-UHFFFAOYSA-N
MW415.52 g/mol
LogP2.69
Rot. Bonds7

About N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide

N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide (PubChem CID 24718563) has the molecular formula C21H25N3O4S and a molecular weight of 415.52 g/mol. Its IUPAC name is N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide
PubChem CID24718563
Molecular FormulaC21H25N3O4S
Molecular Weight415.52 g/mol
Exact Mass415.16
IUPAC NameN-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide
SMILESCOc1ccc(N2CN(C(=O)CN(CC(C)C)C(=O)c3cccs3)CC2=O)cc1
InChIInChI=1S/C21H25N3O4S/c1-15(2)11-22(21(27)18-5-4-10-29-18)12-19(25)23-13-20(26)24(14-23)16-6-8-17(28-3)9-7-16/h4-10,15H,11-14H2,1-3H3
InChIKeyIYSUWUDGWYHYRR-UHFFFAOYSA-N
XLogP2.69
TPSA70.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.52
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-[[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-(2-methylpropyl)amino]-4-oxobutanoate
CID 3412421
2-methoxy-N-[2-[3-(4-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)acetamide
CID 42770015
4-ethyl-N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)benzamide
CID 5121903
N-[2-[3-(4-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-2,4-dimethoxy-N-propan-2-ylbenzamide
CID 5145817
N-[2-[4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl]-2-oxoethyl]-N-(3-methylbutyl)thiophene-2-carboxamide
CID 46001390
N-[2-[4-[(4-chlorophenoxy)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide
CID 46009876
N-[2-[4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-2-oxoethyl]-N-propylthiophene-2-carboxamide
CID 46147144
N-[2-[3-(4-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-cyclopropyl-3-methoxybenzamide
CID 3976777
1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
CID 585094
N-[2-[3-(4-fluorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)naphthalene-1-sulfonamide
CID 42766574
2-[[1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carbonyl]-(2-methylpropyl)amino]acetic acid
CID 119193196
N-tert-butyl-N-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]thiophene-2-carboxamide
CID 23859411

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide?
The IUPAC name of N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide (CID 24718563) is N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide?
The canonical SMILES for N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide is COc1ccc(N2CN(C(=O)CN(CC(C)C)C(=O)c3cccs3)CC2=O)cc1.
What is the InChIKey of N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide?
The InChIKey is IYSUWUDGWYHYRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4S/c1-15(2)11-22(21(27)18-5-4-10-29-18)12-19(25)23-13-20(26)24(14-23)16-6-8-17(28-3)9-7-16/h4-10,15H,11-14H2,1-3H3.
What are the key properties of N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide?
N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide has a molecular weight of 415.52 g/mol, XLogP of 2.69, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(4-methoxyphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 24718563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).