4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine

C11H18N2O2 — CID 166789384

IUPAC4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine
SMILESCC(C)c1ocnc1CN1CCOCC1
InChIInChI=1S/C11H18N2O2/c1-9(2)11-10(12-8-15-11)7-13-3-5-14-6-4-13/h8-9H,3-7H2,1-2H3
InChIKeySQYDTYLLGJZBMQ-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.63
Rot. Bonds3

About 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine

4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine (PubChem CID 166789384) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine
PubChem CID166789384
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine
SMILESCC(C)c1ocnc1CN1CCOCC1
InChIInChI=1S/C11H18N2O2/c1-9(2)11-10(12-8-15-11)7-13-3-5-14-6-4-13/h8-9H,3-7H2,1-2H3
InChIKeySQYDTYLLGJZBMQ-UHFFFAOYSA-N
XLogP1.63
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine?
The IUPAC name of 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine (CID 166789384) is 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine.
What is the SMILES notation for 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine?
The canonical SMILES for 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine is CC(C)c1ocnc1CN1CCOCC1.
What is the InChIKey of 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine?
The InChIKey is SQYDTYLLGJZBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9(2)11-10(12-8-15-11)7-13-3-5-14-6-4-13/h8-9H,3-7H2,1-2H3.
What are the key properties of 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine?
4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine has a molecular weight of 210.28 g/mol, XLogP of 1.63, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]morpholine is sourced from PubChem (CID 166789384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).