3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane

C8H15NO2 — CID 156894302

IUPAC3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane
SMILESC=C1C(C)OC(=O)N1C.CC
InChIInChI=1S/C6H9NO2.C2H6/c1-4-5(2)9-6(8)7(4)3;1-2/h5H,1H2,2-3H3;1-2H3
InChIKeyDODHSZQHHXTRLF-UHFFFAOYSA-N
MW157.21 g/mol
LogP2.00
Rot. Bonds

About 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane

3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane (PubChem CID 156894302) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane.

Molecular Properties

Compound Name3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane
PubChem CID156894302
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane
SMILESC=C1C(C)OC(=O)N1C.CC
InChIInChI=1S/C6H9NO2.C2H6/c1-4-5(2)9-6(8)7(4)3;1-2/h5H,1H2,2-3H3;1-2H3
InChIKeyDODHSZQHHXTRLF-UHFFFAOYSA-N
XLogP2.00
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane?
The IUPAC name of 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane (CID 156894302) is 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane.
What is the SMILES notation for 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane?
The canonical SMILES for 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane is C=C1C(C)OC(=O)N1C.CC.
What is the InChIKey of 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane?
The InChIKey is DODHSZQHHXTRLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2.C2H6/c1-4-5(2)9-6(8)7(4)3;1-2/h5H,1H2,2-3H3;1-2H3.
What are the key properties of 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane?
3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane has a molecular weight of 157.21 g/mol, XLogP of 2.00, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-methylidene-1,3-oxazolidin-2-one;ethane is sourced from PubChem (CID 156894302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).