1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea

C9H18N4O2 — CID 2811176

IUPAC1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea
SMILESCCCNC(=O)NCCN1CCNC1=O
InChIInChI=1S/C9H18N4O2/c1-2-3-10-8(14)11-4-6-13-7-5-12-9(13)15/h2-7H2,1H3,(H,12,15)(H2,10,11,14)
InChIKeyDCQPCRIBLDMCES-UHFFFAOYSA-N
MW214.27 g/mol
LogP-0.28
Rot. Bonds5

About 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea

1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea (PubChem CID 2811176) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea.

Molecular Properties

Compound Name1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea
PubChem CID2811176
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC Name1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea
SMILESCCCNC(=O)NCCN1CCNC1=O
InChIInChI=1S/C9H18N4O2/c1-2-3-10-8(14)11-4-6-13-7-5-12-9(13)15/h2-7H2,1H3,(H,12,15)(H2,10,11,14)
InChIKeyDCQPCRIBLDMCES-UHFFFAOYSA-N
XLogP-0.28
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea?
The IUPAC name of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea (CID 2811176) is 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea.
What is the SMILES notation for 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea?
The canonical SMILES for 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea is CCCNC(=O)NCCN1CCNC1=O.
What is the InChIKey of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea?
The InChIKey is DCQPCRIBLDMCES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O2/c1-2-3-10-8(14)11-4-6-13-7-5-12-9(13)15/h2-7H2,1H3,(H,12,15)(H2,10,11,14).
What are the key properties of 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea?
1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea has a molecular weight of 214.27 g/mol, XLogP of -0.28, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-propylurea is sourced from PubChem (CID 2811176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).