1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea

C15H23N5O4S — CID 118780196

IUPAC1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)NCCN2CCNC2=O)cc1
InChIInChI=1S/C15H23N5O4S/c1-2-7-18-25(23,24)13-5-3-12(4-6-13)19-14(21)16-8-10-20-11-9-17-15(20)22/h3-6,18H,2,7-11H2,1H3,(H,17,22)(H2,16,19,21)
InChIKeyVVAXSBFJAGAXNC-UHFFFAOYSA-N
MW369.45 g/mol
LogP0.52
Rot. Bonds8

About 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea

1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea (PubChem CID 118780196) has the molecular formula C15H23N5O4S and a molecular weight of 369.45 g/mol. Its IUPAC name is 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea.

Molecular Properties

Compound Name1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea
PubChem CID118780196
Molecular FormulaC15H23N5O4S
Molecular Weight369.45 g/mol
Exact Mass369.15
IUPAC Name1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)NCCN2CCNC2=O)cc1
InChIInChI=1S/C15H23N5O4S/c1-2-7-18-25(23,24)13-5-3-12(4-6-13)19-14(21)16-8-10-20-11-9-17-15(20)22/h3-6,18H,2,7-11H2,1H3,(H,17,22)(H2,16,19,21)
InChIKeyVVAXSBFJAGAXNC-UHFFFAOYSA-N
XLogP0.52
TPSA119.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 50.52
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea?
The IUPAC name of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea (CID 118780196) is 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea.
What is the SMILES notation for 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea?
The canonical SMILES for 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea is CCCNS(=O)(=O)c1ccc(NC(=O)NCCN2CCNC2=O)cc1.
What is the InChIKey of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea?
The InChIKey is VVAXSBFJAGAXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O4S/c1-2-7-18-25(23,24)13-5-3-12(4-6-13)19-14(21)16-8-10-20-11-9-17-15(20)22/h3-6,18H,2,7-11H2,1H3,(H,17,22)(H2,16,19,21).
What are the key properties of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea?
1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea has a molecular weight of 369.45 g/mol, XLogP of 0.52, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[4-(propylsulfamoyl)phenyl]urea is sourced from PubChem (CID 118780196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).