methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione

C7H13NO3 — CID 157467246

IUPACmethane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione
SMILESC.CN1C(=O)OC(C)(C)C1=O
InChIInChI=1S/C6H9NO3.CH4/c1-6(2)4(8)7(3)5(9)10-6;/h1-3H3;1H4
InChIKeyOIEYHGDLKPGPAY-UHFFFAOYSA-N
MW159.19 g/mol
LogP1.01
Rot. Bonds

About methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione

methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione (PubChem CID 157467246) has the molecular formula C7H13NO3 and a molecular weight of 159.19 g/mol. Its IUPAC name is methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Namemethane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione
PubChem CID157467246
Molecular FormulaC7H13NO3
Molecular Weight159.19 g/mol
Exact Mass159.09
IUPAC Namemethane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione
SMILESC.CN1C(=O)OC(C)(C)C1=O
InChIInChI=1S/C6H9NO3.CH4/c1-6(2)4(8)7(3)5(9)10-6;/h1-3H3;1H4
InChIKeyOIEYHGDLKPGPAY-UHFFFAOYSA-N
XLogP1.01
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione (CID 157467246) is methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione is C.CN1C(=O)OC(C)(C)C1=O.
What is the InChIKey of methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione?
The InChIKey is OIEYHGDLKPGPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3.CH4/c1-6(2)4(8)7(3)5(9)10-6;/h1-3H3;1H4.
What are the key properties of methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione?
methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione has a molecular weight of 159.19 g/mol, XLogP of 1.01, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;3,5,5-trimethyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 157467246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).