1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea

C10H16N4O3 — CID 108814031

IUPAC1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea
SMILESO=C(NCCN1CCOCC1)Nc1ccno1
InChIInChI=1S/C10H16N4O3/c15-10(13-9-1-2-12-17-9)11-3-4-14-5-7-16-8-6-14/h1-2H,3-8H2,(H2,11,13,15)
InChIKeyNYTMPTIQVKYIOS-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.13
Rot. Bonds4

About 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea

1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea (PubChem CID 108814031) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea
PubChem CID108814031
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC Name1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea
SMILESO=C(NCCN1CCOCC1)Nc1ccno1
InChIInChI=1S/C10H16N4O3/c15-10(13-9-1-2-12-17-9)11-3-4-14-5-7-16-8-6-14/h1-2H,3-8H2,(H2,11,13,15)
InChIKeyNYTMPTIQVKYIOS-UHFFFAOYSA-N
XLogP0.13
TPSA79.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea (CID 108814031) is 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea is O=C(NCCN1CCOCC1)Nc1ccno1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea?
The InChIKey is NYTMPTIQVKYIOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c15-10(13-9-1-2-12-17-9)11-3-4-14-5-7-16-8-6-14/h1-2H,3-8H2,(H2,11,13,15).
What are the key properties of 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea?
1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea has a molecular weight of 240.26 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-3-(1,2-oxazol-5-yl)urea is sourced from PubChem (CID 108814031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).