2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine

C9H14N2O2 — CID 130668586

IUPAC2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine
SMILESCC1CN(Cc2ccno2)CCO1
InChIInChI=1S/C9H14N2O2/c1-8-6-11(4-5-12-8)7-9-2-3-10-13-9/h2-3,8H,4-7H2,1H3
InChIKeyGLEMULDTTUHRBY-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.90
Rot. Bonds2

About 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine

2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine (PubChem CID 130668586) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine.

Molecular Properties

Compound Name2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine
PubChem CID130668586
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine
SMILESCC1CN(Cc2ccno2)CCO1
InChIInChI=1S/C9H14N2O2/c1-8-6-11(4-5-12-8)7-9-2-3-10-13-9/h2-3,8H,4-7H2,1H3
InChIKeyGLEMULDTTUHRBY-UHFFFAOYSA-N
XLogP0.90
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine?
The IUPAC name of 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine (CID 130668586) is 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine.
What is the SMILES notation for 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine?
The canonical SMILES for 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine is CC1CN(Cc2ccno2)CCO1.
What is the InChIKey of 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine?
The InChIKey is GLEMULDTTUHRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-8-6-11(4-5-12-8)7-9-2-3-10-13-9/h2-3,8H,4-7H2,1H3.
What are the key properties of 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine?
2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine has a molecular weight of 182.22 g/mol, XLogP of 0.90, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(1,2-oxazol-5-ylmethyl)morpholine is sourced from PubChem (CID 130668586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).