N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide

C13H21N3O4 — CID 46341206

IUPACN-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESCOCCNC(=O)c1noc(C)c1CN1CCOCC1
InChIInChI=1S/C13H21N3O4/c1-10-11(9-16-4-7-19-8-5-16)12(15-20-10)13(17)14-3-6-18-2/h3-9H2,1-2H3,(H,14,17)
InChIKeyXABVYOBVFROBPU-UHFFFAOYSA-N
MW283.33 g/mol
LogP0.19
Rot. Bonds6

About N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide

N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide (PubChem CID 46341206) has the molecular formula C13H21N3O4 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
PubChem CID46341206
Molecular FormulaC13H21N3O4
Molecular Weight283.33 g/mol
Exact Mass283.15
IUPAC NameN-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESCOCCNC(=O)c1noc(C)c1CN1CCOCC1
InChIInChI=1S/C13H21N3O4/c1-10-11(9-16-4-7-19-8-5-16)12(15-20-10)13(17)14-3-6-18-2/h3-9H2,1-2H3,(H,14,17)
InChIKeyXABVYOBVFROBPU-UHFFFAOYSA-N
XLogP0.19
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[(5-Methyl-4-nitroisoxazol-3-yl)carbonyl]morpholine
CID 16188083
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 45805111
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 45805291
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-morpholin-4-ylpropyl)acetamide
CID 45812733
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-pyrrolidin-1-ylbutyl)acetamide
CID 45887235
3,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,2-oxazole-4-carboxamide
CID 47110196
3-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 47116520
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]acetamide
CID 75462334
N-[[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-3-yl]methyl]acetamide
CID 75462370
2-[(3,5-Dimethyl-1,2-oxazol-4-yl)methylamino]-3-methyl-1-morpholin-4-ylbutan-1-one
CID 84598270
(2R)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 93260440
N-[2-(dimethylamino)ethyl]-5-(2-methylpropanoyl)-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide
CID 97404558

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide (CID 46341206) is N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide is COCCNC(=O)c1noc(C)c1CN1CCOCC1.
What is the InChIKey of N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is XABVYOBVFROBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O4/c1-10-11(9-16-4-7-19-8-5-16)12(15-20-10)13(17)14-3-6-18-2/h3-9H2,1-2H3,(H,14,17).
What are the key properties of N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 0.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 46341206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).