2-(5-cyclohexylindol-1-yl)ethanamine

C16H22N2 — CID 151999952

IUPAC2-(5-cyclohexylindol-1-yl)ethanamine
SMILESNCCn1ccc2cc(C3CCCCC3)ccc21
InChIInChI=1S/C16H22N2/c17-9-11-18-10-8-15-12-14(6-7-16(15)18)13-4-2-1-3-5-13/h6-8,10,12-13H,1-5,9,11,17H2
InChIKeyUGMABWZHQZPMOI-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.65
Rot. Bonds3

About 2-(5-cyclohexylindol-1-yl)ethanamine

2-(5-cyclohexylindol-1-yl)ethanamine (PubChem CID 151999952) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 2-(5-cyclohexylindol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(5-cyclohexylindol-1-yl)ethanamine
PubChem CID151999952
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name2-(5-cyclohexylindol-1-yl)ethanamine
SMILESNCCn1ccc2cc(C3CCCCC3)ccc21
InChIInChI=1S/C16H22N2/c17-9-11-18-10-8-15-12-14(6-7-16(15)18)13-4-2-1-3-5-13/h6-8,10,12-13H,1-5,9,11,17H2
InChIKeyUGMABWZHQZPMOI-UHFFFAOYSA-N
XLogP3.65
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-cyclohexylindol-1-yl)ethanamine?
The IUPAC name of 2-(5-cyclohexylindol-1-yl)ethanamine (CID 151999952) is 2-(5-cyclohexylindol-1-yl)ethanamine.
What is the SMILES notation for 2-(5-cyclohexylindol-1-yl)ethanamine?
The canonical SMILES for 2-(5-cyclohexylindol-1-yl)ethanamine is NCCn1ccc2cc(C3CCCCC3)ccc21.
What is the InChIKey of 2-(5-cyclohexylindol-1-yl)ethanamine?
The InChIKey is UGMABWZHQZPMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c17-9-11-18-10-8-15-12-14(6-7-16(15)18)13-4-2-1-3-5-13/h6-8,10,12-13H,1-5,9,11,17H2.
What are the key properties of 2-(5-cyclohexylindol-1-yl)ethanamine?
2-(5-cyclohexylindol-1-yl)ethanamine has a molecular weight of 242.37 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyclohexylindol-1-yl)ethanamine is sourced from PubChem (CID 151999952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).