5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one

C10H17NO3 — CID 11644096

IUPAC5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one
SMILESC=C1CN(CCOC(C)(C)C)C(=O)O1
InChIInChI=1S/C10H17NO3/c1-8-7-11(9(12)14-8)5-6-13-10(2,3)4/h1,5-7H2,2-4H3
InChIKeyWSKFVAXWJZJUJE-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.77
Rot. Bonds3

About 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one

5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one (PubChem CID 11644096) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one
PubChem CID11644096
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one
SMILESC=C1CN(CCOC(C)(C)C)C(=O)O1
InChIInChI=1S/C10H17NO3/c1-8-7-11(9(12)14-8)5-6-13-10(2,3)4/h1,5-7H2,2-4H3
InChIKeyWSKFVAXWJZJUJE-UHFFFAOYSA-N
XLogP1.77
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4R)-2,2-Dimethyl-4-vinyloxazolidine-3-carboxylic acid tert-butyl ester
CID 10878894
Tert-butyl 2,2-dimethyl-4-vinyloxazolidine-3-carboxylate
CID 13905152
Tert-butyl 2-prop-2-enyl-1,3-oxazolidine-3-carboxylate
CID 91345344
Tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
CID 11020618
5-Methyl-3-(2-methylprop-2-enyl)-1,3-oxazolidin-2-one
CID 22133409
2,2-Dimethyloxazolidine-3-carboxylic acid tert-butyl ester
CID 54531405
5-Ethyl-3-(2-methylprop-2-enyl)-1,3-oxazolidin-2-one
CID 59988970
Tert-butyl 2-ethenyl-1,3-oxazolidine-3-carboxylate
CID 101909424
3-Tert-butyl-5-methylidene-1,3-oxazolidin-2-one
CID 123827412
3-[2-[(2-Methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one
CID 134473019
Tert-butyl 3-methoxy-2,5-dihydropyrrole-1-carboxylate
CID 138746993
Tert-butyl 2-methyl-1,3-oxazolidine-3-carboxylate
CID 141017816

Frequently Asked Questions

What is the IUPAC name of 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one (CID 11644096) is 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one is C=C1CN(CCOC(C)(C)C)C(=O)O1.
What is the InChIKey of 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one?
The InChIKey is WSKFVAXWJZJUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-8-7-11(9(12)14-8)5-6-13-10(2,3)4/h1,5-7H2,2-4H3.
What are the key properties of 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one?
5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one has a molecular weight of 199.25 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 11644096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).