1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea

C25H32N6O5 — CID 167826131

IUPAC1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea
SMILESCc1cc(OCCN2CCNC2=O)ccc1NC(=O)Nc1ccc(OCCN2CCNC2=O)cc1C
InChIInChI=1S/C25H32N6O5/c1-17-15-19(35-13-11-30-9-7-26-24(30)33)3-5-21(17)28-23(32)29-22-6-4-20(16-18(22)2)36-14-12-31-10-8-27-25(31)34/h3-6,15-16H,7-14H2,1-2H3,(H,26,33)(H,27,34)(H2,28,29,32)
InChIKeyODPRESUATSVZEA-UHFFFAOYSA-N
MW496.57 g/mol
LogP2.76
Rot. Bonds10

About 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea

1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea (PubChem CID 167826131) has the molecular formula C25H32N6O5 and a molecular weight of 496.57 g/mol. Its IUPAC name is 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea.

Molecular Properties

Compound Name1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea
PubChem CID167826131
Molecular FormulaC25H32N6O5
Molecular Weight496.57 g/mol
Exact Mass496.24
IUPAC Name1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea
SMILESCc1cc(OCCN2CCNC2=O)ccc1NC(=O)Nc1ccc(OCCN2CCNC2=O)cc1C
InChIInChI=1S/C25H32N6O5/c1-17-15-19(35-13-11-30-9-7-26-24(30)33)3-5-21(17)28-23(32)29-22-6-4-20(16-18(22)2)36-14-12-31-10-8-27-25(31)34/h3-6,15-16H,7-14H2,1-2H3,(H,26,33)(H,27,34)(H2,28,29,32)
InChIKeyODPRESUATSVZEA-UHFFFAOYSA-N
XLogP2.76
TPSA124.27 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500496.57
LogP ≤ 52.76
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(4-bromo-3-methylphenoxy)ethyl]imidazolidin-2-one
CID 83133891
1-[2-(4-methoxy-2-methylanilino)ethyl]imidazolidin-2-one
CID 62873354
1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one
CID 107684155
5-bromo-3-methyl-2-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzoic acid
CID 115961943
1-[2-(1-methylpyrazol-4-yl)oxyethyl]imidazolidin-2-one
CID 116793935
1-[2-[3-[1-(methylamino)ethyl]phenoxy]ethyl]imidazolidin-2-one
CID 43279878
1-[2-[[1-(methylamino)-2,3-dihydro-1H-inden-5-yl]oxy]ethyl]imidazolidin-2-one
CID 107683575
1-[4-(2-methoxyethoxy)-2-methylphenyl]-3-(4-methoxyphenyl)urea
CID 51088888
1-[2-[3-[hydroxy(methyl)amino]-2,4,6-trimethylphenoxy]ethyl]imidazolidin-2-one
CID 123156882
1-[2-[2-(aminomethyl)-5-propoxyphenoxy]ethyl]imidazolidin-2-one
CID 43472113
1-(4-butoxy-2-methylphenyl)-3-(2-oxo-2-pyrrolidin-1-ylethyl)urea
CID 60554085
1-[2-[2-(3-methylphenoxy)ethylamino]ethyl]imidazolidin-2-one
CID 55013001

Frequently Asked Questions

What is the IUPAC name of 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea?
The IUPAC name of 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea (CID 167826131) is 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea.
What is the SMILES notation for 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea?
The canonical SMILES for 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea is Cc1cc(OCCN2CCNC2=O)ccc1NC(=O)Nc1ccc(OCCN2CCNC2=O)cc1C.
What is the InChIKey of 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea?
The InChIKey is ODPRESUATSVZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N6O5/c1-17-15-19(35-13-11-30-9-7-26-24(30)33)3-5-21(17)28-23(32)29-22-6-4-20(16-18(22)2)36-14-12-31-10-8-27-25(31)34/h3-6,15-16H,7-14H2,1-2H3,(H,26,33)(H,27,34)(H2,28,29,32).
What are the key properties of 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea?
1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea has a molecular weight of 496.57 g/mol, XLogP of 2.76, 10 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis[2-methyl-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]phenyl]urea is sourced from PubChem (CID 167826131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).