3-(1-hydroxypropyl)-1,3-oxazolidin-2-one

C6H11NO3 — CID 22360087

IUPAC3-(1-hydroxypropyl)-1,3-oxazolidin-2-one
SMILESCCC(O)N1CCOC1=O
InChIInChI=1S/C6H11NO3/c1-2-5(8)7-3-4-10-6(7)9/h5,8H,2-4H2,1H3
InChIKeyMKWOZJCIIYFMPE-UHFFFAOYSA-N
MW145.16 g/mol
LogP0.17
Rot. Bonds2

About 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one

3-(1-hydroxypropyl)-1,3-oxazolidin-2-one (PubChem CID 22360087) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(1-hydroxypropyl)-1,3-oxazolidin-2-one
PubChem CID22360087
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name3-(1-hydroxypropyl)-1,3-oxazolidin-2-one
SMILESCCC(O)N1CCOC1=O
InChIInChI=1S/C6H11NO3/c1-2-5(8)7-3-4-10-6(7)9/h5,8H,2-4H2,1H3
InChIKeyMKWOZJCIIYFMPE-UHFFFAOYSA-N
XLogP0.17
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one (CID 22360087) is 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one is CCC(O)N1CCOC1=O.
What is the InChIKey of 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one?
The InChIKey is MKWOZJCIIYFMPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-2-5(8)7-3-4-10-6(7)9/h5,8H,2-4H2,1H3.
What are the key properties of 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one?
3-(1-hydroxypropyl)-1,3-oxazolidin-2-one has a molecular weight of 145.16 g/mol, XLogP of 0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxypropyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 22360087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).