N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide

C7H10N2O3 — CID 130735090

IUPACN-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide
SMILESCCN(C)C(=O)c1cc(=O)[nH]o1
InChIInChI=1S/C7H10N2O3/c1-3-9(2)7(11)5-4-6(10)8-12-5/h4H,3H2,1-2H3,(H,8,10)
InChIKeyOGNWMVOSYOYMGL-UHFFFAOYSA-N
MW170.17 g/mol
LogP0.06
Rot. Bonds2

About N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide

N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide (PubChem CID 130735090) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide
PubChem CID130735090
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC NameN-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide
SMILESCCN(C)C(=O)c1cc(=O)[nH]o1
InChIInChI=1S/C7H10N2O3/c1-3-9(2)7(11)5-4-6(10)8-12-5/h4H,3H2,1-2H3,(H,8,10)
InChIKeyOGNWMVOSYOYMGL-UHFFFAOYSA-N
XLogP0.06
TPSA66.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
The IUPAC name of N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide (CID 130735090) is N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide is CCN(C)C(=O)c1cc(=O)[nH]o1.
What is the InChIKey of N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
The InChIKey is OGNWMVOSYOYMGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c1-3-9(2)7(11)5-4-6(10)8-12-5/h4H,3H2,1-2H3,(H,8,10).
What are the key properties of N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide?
N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide has a molecular weight of 170.17 g/mol, XLogP of 0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-3-oxo-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 130735090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).