5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide

C6H10N2O3 — CID 135318115

IUPAC5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide
SMILESCC1(C)CC(=O)N(C(N)=O)O1
InChIInChI=1S/C6H10N2O3/c1-6(2)3-4(9)8(11-6)5(7)10/h3H2,1-2H3,(H2,7,10)
InChIKeyMDTAUTYTFVZMCC-UHFFFAOYSA-N
MW158.16 g/mol
LogP0.01
Rot. Bonds

About 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide

5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide (PubChem CID 135318115) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide.

Molecular Properties

Compound Name5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide
PubChem CID135318115
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide
SMILESCC1(C)CC(=O)N(C(N)=O)O1
InChIInChI=1S/C6H10N2O3/c1-6(2)3-4(9)8(11-6)5(7)10/h3H2,1-2H3,(H2,7,10)
InChIKeyMDTAUTYTFVZMCC-UHFFFAOYSA-N
XLogP0.01
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide?
The IUPAC name of 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide (CID 135318115) is 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide.
What is the SMILES notation for 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide?
The canonical SMILES for 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide is CC1(C)CC(=O)N(C(N)=O)O1.
What is the InChIKey of 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide?
The InChIKey is MDTAUTYTFVZMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-6(2)3-4(9)8(11-6)5(7)10/h3H2,1-2H3,(H2,7,10).
What are the key properties of 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide?
5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide has a molecular weight of 158.16 g/mol, XLogP of 0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-oxo-1,2-oxazolidine-2-carboxamide is sourced from PubChem (CID 135318115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).