2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine

C18H35NO — CID 3066150

IUPAC2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine
SMILESCCN(CC)CCOC1(C2CCCCC2)CCCCC1
InChIInChI=1S/C18H35NO/c1-3-19(4-2)15-16-20-18(13-9-6-10-14-18)17-11-7-5-8-12-17/h17H,3-16H2,1-2H3
InChIKeyZIRUYTCAIISYIG-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.63
Rot. Bonds7

About 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine

2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine (PubChem CID 3066150) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine.

Molecular Properties

Compound Name2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine
PubChem CID3066150
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine
SMILESCCN(CC)CCOC1(C2CCCCC2)CCCCC1
InChIInChI=1S/C18H35NO/c1-3-19(4-2)15-16-20-18(13-9-6-10-14-18)17-11-7-5-8-12-17/h17H,3-16H2,1-2H3
InChIKeyZIRUYTCAIISYIG-UHFFFAOYSA-N
XLogP4.63
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine?
The IUPAC name of 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine (CID 3066150) is 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine.
What is the SMILES notation for 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine?
The canonical SMILES for 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine is CCN(CC)CCOC1(C2CCCCC2)CCCCC1.
What is the InChIKey of 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine?
The InChIKey is ZIRUYTCAIISYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-3-19(4-2)15-16-20-18(13-9-6-10-14-18)17-11-7-5-8-12-17/h17H,3-16H2,1-2H3.
What are the key properties of 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine?
2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine has a molecular weight of 281.48 g/mol, XLogP of 4.63, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylcyclohexyl)oxy-N,N-diethylethanamine is sourced from PubChem (CID 3066150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).