3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one

C12H18N2O4 — CID 560303

IUPAC3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1C1CCC(N2CCOC2=O)CC1
InChIInChI=1S/C12H18N2O4/c15-11-13(5-7-17-11)9-1-2-10(4-3-9)14-6-8-18-12(14)16/h9-10H,1-8H2
InChIKeyFNKMJUVJWYIBOE-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.20
Rot. Bonds2

About 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one

3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one (PubChem CID 560303) has the molecular formula C12H18N2O4 and a molecular weight of 254.29 g/mol. Its IUPAC name is 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one
PubChem CID560303
Molecular FormulaC12H18N2O4
Molecular Weight254.29 g/mol
Exact Mass254.13
IUPAC Name3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1C1CCC(N2CCOC2=O)CC1
InChIInChI=1S/C12H18N2O4/c15-11-13(5-7-17-11)9-1-2-10(4-3-9)14-6-8-18-12(14)16/h9-10H,1-8H2
InChIKeyFNKMJUVJWYIBOE-UHFFFAOYSA-N
XLogP1.20
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one (CID 560303) is 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one is O=C1OCCN1C1CCC(N2CCOC2=O)CC1.
What is the InChIKey of 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one?
The InChIKey is FNKMJUVJWYIBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4/c15-11-13(5-7-17-11)9-1-2-10(4-3-9)14-6-8-18-12(14)16/h9-10H,1-8H2.
What are the key properties of 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one?
3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one has a molecular weight of 254.29 g/mol, XLogP of 1.20, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 560303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).