[(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate

C10H16N2O4 — CID 175007792

IUPAC[(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate
SMILESNC(=O)O[C@@H]1CCCC[C@H]1N1CCOC1=O
InChIInChI=1S/C10H16N2O4/c11-9(13)16-8-4-2-1-3-7(8)12-5-6-15-10(12)14/h7-8H,1-6H2,(H2,11,13)/t7-,8-/m1/s1
InChIKeyBVCDJXAIHWDMIK-HTQZYQBOSA-N
MW228.25 g/mol
LogP0.85
Rot. Bonds2

About [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate

[(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate (PubChem CID 175007792) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate.

Molecular Properties

Compound Name[(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate
PubChem CID175007792
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Name[(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate
SMILESNC(=O)O[C@@H]1CCCC[C@H]1N1CCOC1=O
InChIInChI=1S/C10H16N2O4/c11-9(13)16-8-4-2-1-3-7(8)12-5-6-15-10(12)14/h7-8H,1-6H2,(H2,11,13)/t7-,8-/m1/s1
InChIKeyBVCDJXAIHWDMIK-HTQZYQBOSA-N
XLogP0.85
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate?
The IUPAC name of [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate (CID 175007792) is [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate.
What is the SMILES notation for [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate?
The canonical SMILES for [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate is NC(=O)O[C@@H]1CCCC[C@H]1N1CCOC1=O.
What is the InChIKey of [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate?
The InChIKey is BVCDJXAIHWDMIK-HTQZYQBOSA-N. The full InChI is InChI=1S/C10H16N2O4/c11-9(13)16-8-4-2-1-3-7(8)12-5-6-15-10(12)14/h7-8H,1-6H2,(H2,11,13)/t7-,8-/m1/s1.
What are the key properties of [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate?
[(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate has a molecular weight of 228.25 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(2-oxo-1,3-oxazolidin-3-yl)cyclohexyl] carbamate is sourced from PubChem (CID 175007792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).