N-methoxy-N-methyl-1,3-oxazole-5-carboxamide

C6H8N2O3 — CID 87693094

IUPACN-methoxy-N-methyl-1,3-oxazole-5-carboxamide
SMILESCON(C)C(=O)c1cnco1
InChIInChI=1S/C6H8N2O3/c1-8(10-2)6(9)5-3-7-4-11-5/h3-4H,1-2H3
InChIKeyTXDMGOJKSLOWGA-UHFFFAOYSA-N
MW156.14 g/mol
LogP0.31
Rot. Bonds2

About N-methoxy-N-methyl-1,3-oxazole-5-carboxamide

N-methoxy-N-methyl-1,3-oxazole-5-carboxamide (PubChem CID 87693094) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is N-methoxy-N-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-1,3-oxazole-5-carboxamide
PubChem CID87693094
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC NameN-methoxy-N-methyl-1,3-oxazole-5-carboxamide
SMILESCON(C)C(=O)c1cnco1
InChIInChI=1S/C6H8N2O3/c1-8(10-2)6(9)5-3-7-4-11-5/h3-4H,1-2H3
InChIKeyTXDMGOJKSLOWGA-UHFFFAOYSA-N
XLogP0.31
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-Oxazolecarboxaldehyde
CID 11829372
1,3-Oxazole-5-carboxamide
CID 22318809
1-(5-Oxazolyl)ethanone
CID 53407237
1,3-Oxazol-5-yl-(4-propan-2-ylpiperazin-1-yl)methanone
CID 124107661
[(3R,4S)-3-fluoro-4-methoxypiperidin-1-yl]-(1,3-oxazol-5-yl)methanone
CID 129260772
N-(trifluoromethyl)-1,3-oxazole-5-carboxamide
CID 154073475
N-(1-fluoro-2-methylpropan-2-yl)-1,3-oxazole-5-carboxamide
CID 127000366
N-(2-fluoroethyl)-1,3-oxazole-5-carboxamide
CID 130626728
(3,3-Difluoroazetidin-1-yl)-(1,3-oxazol-5-yl)methanone
CID 130649683
N-(2,2-difluoroethyl)-1,3-oxazole-5-carboxamide
CID 130666663
(3-Fluoro-3-methylazetidin-1-yl)-(1,3-oxazol-5-yl)methanone
CID 130709361
N-methyl-1,3-oxazole-5-carboxamide
CID 23525717

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-methoxy-N-methyl-1,3-oxazole-5-carboxamide (CID 87693094) is N-methoxy-N-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-methoxy-N-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-methoxy-N-methyl-1,3-oxazole-5-carboxamide is CON(C)C(=O)c1cnco1.
What is the InChIKey of N-methoxy-N-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is TXDMGOJKSLOWGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c1-8(10-2)6(9)5-3-7-4-11-5/h3-4H,1-2H3.
What are the key properties of N-methoxy-N-methyl-1,3-oxazole-5-carboxamide?
N-methoxy-N-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 156.14 g/mol, XLogP of 0.31, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 87693094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).