2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine

C16H24ClNO — CID 62108606

IUPAC2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine
SMILESCCNCC(OC1CCCCC1)c1ccccc1Cl
InChIInChI=1S/C16H24ClNO/c1-2-18-12-16(14-10-6-7-11-15(14)17)19-13-8-4-3-5-9-13/h6-7,10-11,13,16,18H,2-5,8-9,12H2,1H3
InChIKeyFKKOWAAATNTLPT-UHFFFAOYSA-N
MW281.83 g/mol
LogP4.34
Rot. Bonds6

About 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine

2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine (PubChem CID 62108606) has the molecular formula C16H24ClNO and a molecular weight of 281.83 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine
PubChem CID62108606
Molecular FormulaC16H24ClNO
Molecular Weight281.83 g/mol
Exact Mass281.15
IUPAC Name2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine
SMILESCCNCC(OC1CCCCC1)c1ccccc1Cl
InChIInChI=1S/C16H24ClNO/c1-2-18-12-16(14-10-6-7-11-15(14)17)19-13-8-4-3-5-9-13/h6-7,10-11,13,16,18H,2-5,8-9,12H2,1H3
InChIKeyFKKOWAAATNTLPT-UHFFFAOYSA-N
XLogP4.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.83
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine?
The IUPAC name of 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine (CID 62108606) is 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine.
What is the SMILES notation for 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine?
The canonical SMILES for 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine is CCNCC(OC1CCCCC1)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine?
The InChIKey is FKKOWAAATNTLPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClNO/c1-2-18-12-16(14-10-6-7-11-15(14)17)19-13-8-4-3-5-9-13/h6-7,10-11,13,16,18H,2-5,8-9,12H2,1H3.
What are the key properties of 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine?
2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine has a molecular weight of 281.83 g/mol, XLogP of 4.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine is sourced from PubChem (CID 62108606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).