5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione

C10H15NO3 — CID 70295728

IUPAC5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(CC2CCCCC2)O1
InChIInChI=1S/C10H15NO3/c12-9-8(14-10(13)11-9)6-7-4-2-1-3-5-7/h7-8H,1-6H2,(H,11,12,13)
InChIKeyNWDRUMJTOQGPAM-UHFFFAOYSA-N
MW197.23 g/mol
LogP1.59
Rot. Bonds2

About 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione

5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione (PubChem CID 70295728) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione
PubChem CID70295728
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(CC2CCCCC2)O1
InChIInChI=1S/C10H15NO3/c12-9-8(14-10(13)11-9)6-7-4-2-1-3-5-7/h7-8H,1-6H2,(H,11,12,13)
InChIKeyNWDRUMJTOQGPAM-UHFFFAOYSA-N
XLogP1.59
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione (CID 70295728) is 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione is O=C1NC(=O)C(CC2CCCCC2)O1.
What is the InChIKey of 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione?
The InChIKey is NWDRUMJTOQGPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c12-9-8(14-10(13)11-9)6-7-4-2-1-3-5-7/h7-8H,1-6H2,(H,11,12,13).
What are the key properties of 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione?
5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione has a molecular weight of 197.23 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylmethyl)-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 70295728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).