2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine

C16H22N2O — CID 102917115

IUPAC2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine
SMILESNCCc1cccc2ccn(CCC3CCCO3)c12
InChIInChI=1S/C16H22N2O/c17-9-6-13-3-1-4-14-7-10-18(16(13)14)11-8-15-5-2-12-19-15/h1,3-4,7,10,15H,2,5-6,8-9,11-12,17H2
InChIKeyVBEWVUSRYDTKKQ-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.71
Rot. Bonds5

About 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine

2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine (PubChem CID 102917115) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine.

Molecular Properties

Compound Name2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine
PubChem CID102917115
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine
SMILESNCCc1cccc2ccn(CCC3CCCO3)c12
InChIInChI=1S/C16H22N2O/c17-9-6-13-3-1-4-14-7-10-18(16(13)14)11-8-15-5-2-12-19-15/h1,3-4,7,10,15H,2,5-6,8-9,11-12,17H2
InChIKeyVBEWVUSRYDTKKQ-UHFFFAOYSA-N
XLogP2.71
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-ethyl-1-[3-(oxolan-2-yl)propyl]indole
CID 116618876
2-(1-propylindol-7-yl)ethanamine
CID 102917066
3-(2-aminoethyl)-1-[2-(oxolan-2-yl)ethyl]pyrimidine-2,4-dione
CID 106934183
N-methyl-1-[1-[2-(oxolan-2-yl)ethyl]indol-4-yl]methanamine
CID 65162434
2-(1-cyclobutylindol-7-yl)ethanamine
CID 115115266
2-[1-(2-propan-2-ylsulfonylethyl)indol-7-yl]ethanamine
CID 106720962
2-[3-fluoro-2-[3-(oxolan-2-yl)propoxy]phenyl]ethanamine
CID 112615284
2-[1-[(2-bromophenyl)methyl]indol-7-yl]ethanamine
CID 102917143
[1-methyl-2-[2-(oxolan-2-yl)ethyl]benzimidazol-4-yl]methanamine
CID 104721634
2-(2-aminoethyl)-N-methyl-N-(oxolan-2-ylmethyl)aniline
CID 63787027
2-[1-[3-(oxolan-2-yl)propyl]pyrrolo[2,3-b]pyridin-3-yl]ethanamine
CID 66411455
[1-[3-(oxolan-2-yl)propyl]indol-6-yl]methanamine
CID 65165019

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine?
The IUPAC name of 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine (CID 102917115) is 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine.
What is the SMILES notation for 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine?
The canonical SMILES for 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine is NCCc1cccc2ccn(CCC3CCCO3)c12.
What is the InChIKey of 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine?
The InChIKey is VBEWVUSRYDTKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c17-9-6-13-3-1-4-14-7-10-18(16(13)14)11-8-15-5-2-12-19-15/h1,3-4,7,10,15H,2,5-6,8-9,11-12,17H2.
What are the key properties of 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine?
2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine has a molecular weight of 258.37 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(oxolan-2-yl)ethyl]indol-7-yl]ethanamine is sourced from PubChem (CID 102917115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).