1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea

C13H20N4O2 — CID 91907208

IUPAC1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea
SMILESO=C(NCCc1noc(C2CC2)n1)NC1CCCC1
InChIInChI=1S/C13H20N4O2/c18-13(15-10-3-1-2-4-10)14-8-7-11-16-12(19-17-11)9-5-6-9/h9-10H,1-8H2,(H2,14,15,18)
InChIKeyXMPPFHZLLIAXOS-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.73
Rot. Bonds5

About 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea

1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea (PubChem CID 91907208) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea.

Molecular Properties

Compound Name1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea
PubChem CID91907208
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea
SMILESO=C(NCCc1noc(C2CC2)n1)NC1CCCC1
InChIInChI=1S/C13H20N4O2/c18-13(15-10-3-1-2-4-10)14-8-7-11-16-12(19-17-11)9-5-6-9/h9-10H,1-8H2,(H2,14,15,18)
InChIKeyXMPPFHZLLIAXOS-UHFFFAOYSA-N
XLogP1.73
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea?
The IUPAC name of 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea (CID 91907208) is 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea.
What is the SMILES notation for 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea?
The canonical SMILES for 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea is O=C(NCCc1noc(C2CC2)n1)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea?
The InChIKey is XMPPFHZLLIAXOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c18-13(15-10-3-1-2-4-10)14-8-7-11-16-12(19-17-11)9-5-6-9/h9-10H,1-8H2,(H2,14,15,18).
What are the key properties of 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea?
1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea has a molecular weight of 264.33 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]urea is sourced from PubChem (CID 91907208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).