2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol

C12H16N2O — CID 83859615

IUPAC2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol
SMILESCCc1ccc2[nH]c(C(N)CO)cc2c1
InChIInChI=1S/C12H16N2O/c1-2-8-3-4-11-9(5-8)6-12(14-11)10(13)7-15/h3-6,10,14-15H,2,7,13H2,1H3
InChIKeyJVPNMZNBYOYOFR-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.72
Rot. Bonds3

About 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol

2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol (PubChem CID 83859615) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol
PubChem CID83859615
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol
SMILESCCc1ccc2[nH]c(C(N)CO)cc2c1
InChIInChI=1S/C12H16N2O/c1-2-8-3-4-11-9(5-8)6-12(14-11)10(13)7-15/h3-6,10,14-15H,2,7,13H2,1H3
InChIKeyJVPNMZNBYOYOFR-UHFFFAOYSA-N
XLogP1.72
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-ethyl-1H-indol-2-yl)propanoic acid
CID 83859523
(5-ethyl-1H-indol-2-yl)methanol
CID 21405642
6-ethyl-3-methyl-1H-quinoline-2-thione
CID 18524198
2-amino-2-(7-chloro-1H-indol-2-yl)ethanol
CID 82612595
(2S)-2-amino-2-(7-fluoro-1H-indol-2-yl)ethanol
CID 96754178
6-ethyl-3-[(2-hydroxyethylamino)methyl]-1H-quinolin-2-one
CID 3169171
methyl 5-[(2R)-2-aminobutyl]-1H-indole-2-carboxylate
CID 59979274
2-ethyl-5-propyl-1H-indole
CID 86257176
ethyl 5-(2-hydroxyethyl)-1H-indole-2-carboxylate
CID 68691266
5-ethyl-N-(2-formamidoethyl)-1H-indole-2-carboxamide
CID 145164495
(5-ethyl-1H-indol-2-yl)-methyl-triphenyl-λ5-phosphane
CID 173310644
1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-hydroxyethyl)-3-(2-methylpropyl)thiourea
CID 3170314

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol?
The IUPAC name of 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol (CID 83859615) is 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol.
What is the SMILES notation for 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol?
The canonical SMILES for 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol is CCc1ccc2[nH]c(C(N)CO)cc2c1.
What is the InChIKey of 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol?
The InChIKey is JVPNMZNBYOYOFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-2-8-3-4-11-9(5-8)6-12(14-11)10(13)7-15/h3-6,10,14-15H,2,7,13H2,1H3.
What are the key properties of 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol?
2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol has a molecular weight of 204.27 g/mol, XLogP of 1.72, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(5-ethyl-1H-indol-2-yl)ethanol is sourced from PubChem (CID 83859615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).