5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide

C11H16N2O4 — CID 118545113

IUPAC5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESCOCc1cc(C(=O)NCC2CCOC2)no1
InChIInChI=1S/C11H16N2O4/c1-15-7-9-4-10(13-17-9)11(14)12-5-8-2-3-16-6-8/h4,8H,2-3,5-7H2,1H3,(H,12,14)
InChIKeyJYXNYZSGLGZFQL-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.59
Rot. Bonds5

About 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide

5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide (PubChem CID 118545113) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide
PubChem CID118545113
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC Name5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESCOCc1cc(C(=O)NCC2CCOC2)no1
InChIInChI=1S/C11H16N2O4/c1-15-7-9-4-10(13-17-9)11(14)12-5-8-2-3-16-6-8/h4,8H,2-3,5-7H2,1H3,(H,12,14)
InChIKeyJYXNYZSGLGZFQL-UHFFFAOYSA-N
XLogP0.59
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[1-(tetrahydro-2-furanyl)ethyl]-3-isoxazolecarboxamide
CID 2970309
(5-Methyl-1,2-oxazol-3-yl)[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]methanone
CID 2970475
4-(Methoxymethyl)-N-methyl-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidine-3-carboxamide
CID 124051997
N-[3-(2-methoxyethylamino)-3-oxopropyl]-5-methyl-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 45984451
2-Azaspiro[5.6]dodecan-2-yl-[5-(methoxymethyl)-1,2-oxazol-3-yl]methanone
CID 71926236
5-(methoxymethyl)-N-[2-(2-methylpropyl)oxan-4-yl]-1,2-oxazole-3-carboxamide
CID 75446716
5-(methoxymethyl)-N-[3-[[5-(methoxymethyl)-1,2-oxazole-3-carbonyl]amino]-2,2,4,4-tetramethylcyclobutyl]-1,2-oxazole-3-carboxamide
CID 75534327
5-methyl-N-[3-[[(2R)-oxolan-2-yl]methoxy]propyl]-1,2-oxazole-3-carboxamide
CID 94598736
1-(5-methyl-1,2-oxazole-3-carbonyl)-N-[[(2R)-oxolan-2-yl]methyl]azetidine-3-carboxamide
CID 95377013
Methyl 3-(cycloheptylcarbamoyl)-1,2-oxazole-5-carboxylate
CID 121560384
N-ethyl-N-(2-ethylbutyl)-5-(hydroxymethyl)-1,2-oxazole-3-carboxamide
CID 126801635
1-cyclopropyl-N-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]-5-methylpyrrolidin-3-amine
CID 128701107

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide (CID 118545113) is 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide is COCc1cc(C(=O)NCC2CCOC2)no1.
What is the InChIKey of 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is JYXNYZSGLGZFQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-15-7-9-4-10(13-17-9)11(14)12-5-8-2-3-16-6-8/h4,8H,2-3,5-7H2,1H3,(H,12,14).
What are the key properties of 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide?
5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 240.26 g/mol, XLogP of 0.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-N-(oxolan-3-ylmethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 118545113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).