ethyl N-[3-(ethylamino)cyclohexyl]carbamate

C11H22N2O2 — CID 91257021

IUPACethyl N-[3-(ethylamino)cyclohexyl]carbamate
SMILESCCNC1CCCC(NC(=O)OCC)C1
InChIInChI=1S/C11H22N2O2/c1-3-12-9-6-5-7-10(8-9)13-11(14)15-4-2/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyARALRMVNPYQNKD-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.65
Rot. Bonds4

About ethyl N-[3-(ethylamino)cyclohexyl]carbamate

ethyl N-[3-(ethylamino)cyclohexyl]carbamate (PubChem CID 91257021) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is ethyl N-[3-(ethylamino)cyclohexyl]carbamate.

Molecular Properties

Compound Nameethyl N-[3-(ethylamino)cyclohexyl]carbamate
PubChem CID91257021
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nameethyl N-[3-(ethylamino)cyclohexyl]carbamate
SMILESCCNC1CCCC(NC(=O)OCC)C1
InChIInChI=1S/C11H22N2O2/c1-3-12-9-6-5-7-10(8-9)13-11(14)15-4-2/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyARALRMVNPYQNKD-UHFFFAOYSA-N
XLogP1.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl N-[3-(ethylamino)cyclohexyl]carbamate?
The IUPAC name of ethyl N-[3-(ethylamino)cyclohexyl]carbamate (CID 91257021) is ethyl N-[3-(ethylamino)cyclohexyl]carbamate.
What is the SMILES notation for ethyl N-[3-(ethylamino)cyclohexyl]carbamate?
The canonical SMILES for ethyl N-[3-(ethylamino)cyclohexyl]carbamate is CCNC1CCCC(NC(=O)OCC)C1.
What is the InChIKey of ethyl N-[3-(ethylamino)cyclohexyl]carbamate?
The InChIKey is ARALRMVNPYQNKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-12-9-6-5-7-10(8-9)13-11(14)15-4-2/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of ethyl N-[3-(ethylamino)cyclohexyl]carbamate?
ethyl N-[3-(ethylamino)cyclohexyl]carbamate has a molecular weight of 214.31 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[3-(ethylamino)cyclohexyl]carbamate is sourced from PubChem (CID 91257021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).