cyclohexyl N-cyclohexylcarbamate

C13H23NO2 — CID 3307288

IUPACcyclohexyl N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)OC1CCCCC1
InChIInChI=1S/C13H23NO2/c15-13(14-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h11-12H,1-10H2,(H,14,15)
InChIKeyJEAXEFPTKIJYRO-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.38
Rot. Bonds2

About cyclohexyl N-cyclohexylcarbamate

cyclohexyl N-cyclohexylcarbamate (PubChem CID 3307288) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is cyclohexyl N-cyclohexylcarbamate.

Molecular Properties

Compound Namecyclohexyl N-cyclohexylcarbamate
PubChem CID3307288
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Namecyclohexyl N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)OC1CCCCC1
InChIInChI=1S/C13H23NO2/c15-13(14-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h11-12H,1-10H2,(H,14,15)
InChIKeyJEAXEFPTKIJYRO-UHFFFAOYSA-N
XLogP3.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl N-cyclohexylcarbamate?
The IUPAC name of cyclohexyl N-cyclohexylcarbamate (CID 3307288) is cyclohexyl N-cyclohexylcarbamate.
What is the SMILES notation for cyclohexyl N-cyclohexylcarbamate?
The canonical SMILES for cyclohexyl N-cyclohexylcarbamate is O=C(NC1CCCCC1)OC1CCCCC1.
What is the InChIKey of cyclohexyl N-cyclohexylcarbamate?
The InChIKey is JEAXEFPTKIJYRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c15-13(14-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h11-12H,1-10H2,(H,14,15).
What are the key properties of cyclohexyl N-cyclohexylcarbamate?
cyclohexyl N-cyclohexylcarbamate has a molecular weight of 225.33 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl N-cyclohexylcarbamate is sourced from PubChem (CID 3307288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).