methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate

C11H14N2O5 — CID 115670360

IUPACmethyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate
SMILESCOC(=O)C1COCCN1C(=O)c1oncc1C
InChIInChI=1S/C11H14N2O5/c1-7-5-12-18-9(7)10(14)13-3-4-17-6-8(13)11(15)16-2/h5,8H,3-4,6H2,1-2H3
InChIKeyVDICDVOXSDHIPQ-UHFFFAOYSA-N
MW254.24 g/mol
LogP-0.00
Rot. Bonds2

About methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate

methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate (PubChem CID 115670360) has the molecular formula C11H14N2O5 and a molecular weight of 254.24 g/mol. Its IUPAC name is methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate.

Molecular Properties

Compound Namemethyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate
PubChem CID115670360
Molecular FormulaC11H14N2O5
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC Namemethyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate
SMILESCOC(=O)C1COCCN1C(=O)c1oncc1C
InChIInChI=1S/C11H14N2O5/c1-7-5-12-18-9(7)10(14)13-3-4-17-6-8(13)11(15)16-2/h5,8H,3-4,6H2,1-2H3
InChIKeyVDICDVOXSDHIPQ-UHFFFAOYSA-N
XLogP-0.00
TPSA81.87 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 5-0.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 4-(6-methoxypyridine-3-carbonyl)morpholine-3-carboxylate
CID 115670220
methyl (3R)-4-(3-hydroxy-4-methylbenzoyl)morpholine-3-carboxylate
CID 124603692
methyl 4-(4-amino-3-methylbenzoyl)morpholine-3-carboxylate
CID 104774380
methyl 4-(3-fluoropyridine-4-carbonyl)morpholine-3-carboxylate
CID 115670106
1-(4-methyl-1,2-oxazole-5-carbonyl)pyrrolidine-2-carboxylic acid
CID 66334626
methyl 4-(3-amino-4-methylbenzoyl)morpholine-3-carboxylate
CID 104774364
methyl 4-(3,6-dichloropyridine-2-carbonyl)morpholine-3-carboxylate
CID 115669971
methyl 4-(pyrazolo[1,5-a]pyridine-3-carbonyl)morpholine-3-carboxylate
CID 103719037
methyl 4-(4-chloropyridine-2-carbonyl)morpholine-3-carboxylate
CID 115670216
methyl 4-(3-amino-4-bromobenzoyl)morpholine-3-carboxylate
CID 104774410
methyl 4-(5-ethyl-4-methylthiophene-2-carbonyl)morpholine-3-carboxylate
CID 115670080
methyl 4-(4-chloro-2,5-difluorobenzoyl)morpholine-3-carboxylate
CID 115868973

Frequently Asked Questions

What is the IUPAC name of methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate?
The IUPAC name of methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate (CID 115670360) is methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate.
What is the SMILES notation for methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate?
The canonical SMILES for methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate is COC(=O)C1COCCN1C(=O)c1oncc1C.
What is the InChIKey of methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate?
The InChIKey is VDICDVOXSDHIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O5/c1-7-5-12-18-9(7)10(14)13-3-4-17-6-8(13)11(15)16-2/h5,8H,3-4,6H2,1-2H3.
What are the key properties of methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate?
methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate has a molecular weight of 254.24 g/mol, XLogP of -0.00, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(4-methyl-1,2-oxazole-5-carbonyl)morpholine-3-carboxylate is sourced from PubChem (CID 115670360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).