2-methoxypropane;1,3-oxazolidin-2-one

C7H15NO3 — CID 177227650

IUPAC2-methoxypropane;1,3-oxazolidin-2-one
SMILESCOC(C)C.O=C1NCCO1
InChIInChI=1S/C4H10O.C3H5NO2/c1-4(2)5-3;5-3-4-1-2-6-3/h4H,1-3H3;1-2H2,(H,4,5)
InChIKeyPVZHRQAZJXYHFM-UHFFFAOYSA-N
MW161.20 g/mol
LogP0.77
Rot. Bonds1

About 2-methoxypropane;1,3-oxazolidin-2-one

2-methoxypropane;1,3-oxazolidin-2-one (PubChem CID 177227650) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-methoxypropane;1,3-oxazolidin-2-one.

Molecular Properties

Compound Name2-methoxypropane;1,3-oxazolidin-2-one
PubChem CID177227650
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name2-methoxypropane;1,3-oxazolidin-2-one
SMILESCOC(C)C.O=C1NCCO1
InChIInChI=1S/C4H10O.C3H5NO2/c1-4(2)5-3;5-3-4-1-2-6-3/h4H,1-3H3;1-2H2,(H,4,5)
InChIKeyPVZHRQAZJXYHFM-UHFFFAOYSA-N
XLogP0.77
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Oxazolidinone
CID 73949
5-Methyl-2-oxazolidinone
CID 136837
2-Oxazolidinone, 5,5-dimethyl-
CID 136892
(5R)-5-[(dimethylamino)methyl]-1,3-oxazolidin-2-one
CID 57558000
(5S)-5-[(dimethylamino)methyl]-1,3-oxazolidin-2-one
CID 73351145
4-Ethyl-2-oxazolidinone
CID 97769
4-Methoxy-1,3-oxazolidin-2-one
CID 533641
4-Methyl-1,3-oxazolidin-2-one
CID 9855455
trimethyl-[[(5S)-2-oxo-1,3-oxazolidin-5-yl]methyl]azanium
CID 73349591
trimethyl-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl]azanium
CID 73349592
(S)-4-Methyloxazolidin-2-one
CID 8063308
5-(Iodomethyl)-1,3-oxazolidin-2-one
CID 13788486

Frequently Asked Questions

What is the IUPAC name of 2-methoxypropane;1,3-oxazolidin-2-one?
The IUPAC name of 2-methoxypropane;1,3-oxazolidin-2-one (CID 177227650) is 2-methoxypropane;1,3-oxazolidin-2-one.
What is the SMILES notation for 2-methoxypropane;1,3-oxazolidin-2-one?
The canonical SMILES for 2-methoxypropane;1,3-oxazolidin-2-one is COC(C)C.O=C1NCCO1.
What is the InChIKey of 2-methoxypropane;1,3-oxazolidin-2-one?
The InChIKey is PVZHRQAZJXYHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C3H5NO2/c1-4(2)5-3;5-3-4-1-2-6-3/h4H,1-3H3;1-2H2,(H,4,5).
What are the key properties of 2-methoxypropane;1,3-oxazolidin-2-one?
2-methoxypropane;1,3-oxazolidin-2-one has a molecular weight of 161.20 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxypropane;1,3-oxazolidin-2-one is sourced from PubChem (CID 177227650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).