5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one

C10H15NO3 — CID 105450642

IUPAC5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one
SMILESCC(=O)CCN1OC(C2CC2)CC1=O
InChIInChI=1S/C10H15NO3/c1-7(12)4-5-11-10(13)6-9(14-11)8-2-3-8/h8-9H,2-6H2,1H3
InChIKeyPUSLRPPAWYJFGA-UHFFFAOYSA-N
MW197.23 g/mol
LogP0.91
Rot. Bonds4

About 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one

5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one (PubChem CID 105450642) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one
PubChem CID105450642
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one
SMILESCC(=O)CCN1OC(C2CC2)CC1=O
InChIInChI=1S/C10H15NO3/c1-7(12)4-5-11-10(13)6-9(14-11)8-2-3-8/h8-9H,2-6H2,1H3
InChIKeyPUSLRPPAWYJFGA-UHFFFAOYSA-N
XLogP0.91
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one?
The IUPAC name of 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one (CID 105450642) is 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one.
What is the SMILES notation for 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one?
The canonical SMILES for 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one is CC(=O)CCN1OC(C2CC2)CC1=O.
What is the InChIKey of 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one?
The InChIKey is PUSLRPPAWYJFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-7(12)4-5-11-10(13)6-9(14-11)8-2-3-8/h8-9H,2-6H2,1H3.
What are the key properties of 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one?
5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one has a molecular weight of 197.23 g/mol, XLogP of 0.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-(3-oxobutyl)-1,2-oxazolidin-3-one is sourced from PubChem (CID 105450642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).