3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one

C14H24N2O2 — CID 115065053

IUPAC3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
SMILESCC1(C2CCNC2)CN(C2CCCCC2)C(=O)O1
InChIInChI=1S/C14H24N2O2/c1-14(11-7-8-15-9-11)10-16(13(17)18-14)12-5-3-2-4-6-12/h11-12,15H,2-10H2,1H3
InChIKeyVKSMLROXOSURRP-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.14
Rot. Bonds2

About 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one

3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one (PubChem CID 115065053) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
PubChem CID115065053
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
SMILESCC1(C2CCNC2)CN(C2CCCCC2)C(=O)O1
InChIInChI=1S/C14H24N2O2/c1-14(11-7-8-15-9-11)10-16(13(17)18-14)12-5-3-2-4-6-12/h11-12,15H,2-10H2,1H3
InChIKeyVKSMLROXOSURRP-UHFFFAOYSA-N
XLogP2.14
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The IUPAC name of 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one (CID 115065053) is 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one is CC1(C2CCNC2)CN(C2CCCCC2)C(=O)O1.
What is the InChIKey of 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The InChIKey is VKSMLROXOSURRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-14(11-7-8-15-9-11)10-16(13(17)18-14)12-5-3-2-4-6-12/h11-12,15H,2-10H2,1H3.
What are the key properties of 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one has a molecular weight of 252.36 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 115065053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).