4-(4-benzyl-1,3-oxazol-5-yl)morpholine

C14H16N2O2 — CID 135041945

IUPAC4-(4-benzyl-1,3-oxazol-5-yl)morpholine
SMILESc1ccc(Cc2ncoc2N2CCOCC2)cc1
InChIInChI=1S/C14H16N2O2/c1-2-4-12(5-3-1)10-13-14(18-11-15-13)16-6-8-17-9-7-16/h1-5,11H,6-10H2
InChIKeyDGUPCBYVKNROTJ-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.10
Rot. Bonds3

About 4-(4-benzyl-1,3-oxazol-5-yl)morpholine

4-(4-benzyl-1,3-oxazol-5-yl)morpholine (PubChem CID 135041945) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 4-(4-benzyl-1,3-oxazol-5-yl)morpholine.

Molecular Properties

Compound Name4-(4-benzyl-1,3-oxazol-5-yl)morpholine
PubChem CID135041945
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name4-(4-benzyl-1,3-oxazol-5-yl)morpholine
SMILESc1ccc(Cc2ncoc2N2CCOCC2)cc1
InChIInChI=1S/C14H16N2O2/c1-2-4-12(5-3-1)10-13-14(18-11-15-13)16-6-8-17-9-7-16/h1-5,11H,6-10H2
InChIKeyDGUPCBYVKNROTJ-UHFFFAOYSA-N
XLogP2.10
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-benzyl-1,3-oxazol-5-yl)morpholine?
The IUPAC name of 4-(4-benzyl-1,3-oxazol-5-yl)morpholine (CID 135041945) is 4-(4-benzyl-1,3-oxazol-5-yl)morpholine.
What is the SMILES notation for 4-(4-benzyl-1,3-oxazol-5-yl)morpholine?
The canonical SMILES for 4-(4-benzyl-1,3-oxazol-5-yl)morpholine is c1ccc(Cc2ncoc2N2CCOCC2)cc1.
What is the InChIKey of 4-(4-benzyl-1,3-oxazol-5-yl)morpholine?
The InChIKey is DGUPCBYVKNROTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-2-4-12(5-3-1)10-13-14(18-11-15-13)16-6-8-17-9-7-16/h1-5,11H,6-10H2.
What are the key properties of 4-(4-benzyl-1,3-oxazol-5-yl)morpholine?
4-(4-benzyl-1,3-oxazol-5-yl)morpholine has a molecular weight of 244.29 g/mol, XLogP of 2.10, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-benzyl-1,3-oxazol-5-yl)morpholine is sourced from PubChem (CID 135041945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).