5-(Methoxymethyl)-1,2-oxazole-3-carboxamide

C6H8N2O3 — CID 18521757

IUPAC5-(methoxymethyl)-1,2-oxazole-3-carboxamide
SMILESCOCC1=CC(=NO1)C(=O)N
InChIInChI=1S/C6H8N2O3/c1-10-3-4-2-5(6(7)9)8-11-4/h2H,3H2,1H3,(H2,7,9)
InChIKeyXJISISZPFKFZEU-UHFFFAOYSA-N
MW156.14 g/mol
LogP-0.70
Rot. Bonds3

About 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide

5-(Methoxymethyl)-1,2-oxazole-3-carboxamide (PubChem CID 18521757) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is 5-(methoxymethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(Methoxymethyl)-1,2-oxazole-3-carboxamide
PubChem CID18521757
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC Name5-(methoxymethyl)-1,2-oxazole-3-carboxamide
SMILESCOCC1=CC(=NO1)C(=O)N
InChIInChI=1S/C6H8N2O3/c1-10-3-4-2-5(6(7)9)8-11-4/h2H,3H2,1H3,(H2,7,9)
InChIKeyXJISISZPFKFZEU-UHFFFAOYSA-N
XLogP-0.70
TPSA78.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity151

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Methyl 3-methylisoxazole-5-carboxylate
CID 70492
3-Methylisoxazole-5-carboxylic acid ethyl ester
CID 10329487
5-Methyl-3-isoxazolecarboxamide
CID 76981
5-(Methoxymethyl)-1,2-oxazole-3-carbaldehyde
CID 20099062
Methyl 3-formyl-1,2-oxazole-5-carboxylate
CID 82416446
Isoxazole, 5-(methoxymethyl)-3-methyl-
CID 542401
{5-[(Tert-butoxy)methyl]-1,2-oxazol-3-yl}methanamine
CID 62457747
[5-(Methoxymethyl)-1,2-oxazol-3-yl]methanaminehydrochloride
CID 138040690
N-Chlor-5-methyl-3-isoxazol-carboxamid
CID 45099208
5-[[(2Z,4E)-5-fluoro-2-(1-fluoroethenyl)hexa-2,4-dienoxy]methyl]-1,2-oxazole-3-carbaldehyde
CID 134390221
5-(Hydroxymethyl)-1,2-oxazole-3-carboxamide
CID 8027246
5-(Hydroxymethyl)-1,2-oxazole-3-carbohydrazide
CID 8027247

Frequently Asked Questions

What is the IUPAC name of 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide (CID 18521757) is 5-(methoxymethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide is COCC1=CC(=NO1)C(=O)N.
What is the InChIKey of 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is XJISISZPFKFZEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c1-10-3-4-2-5(6(7)9)8-11-4/h2H,3H2,1H3,(H2,7,9).
What are the key properties of 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide?
5-(Methoxymethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 156.14 g/mol, XLogP of -0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(Methoxymethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 18521757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).