2-(ethylamino)-2-(1H-indol-3-yl)ethanol

C12H16N2O — CID 82282852

IUPAC2-(ethylamino)-2-(1H-indol-3-yl)ethanol
SMILESCCNC(CO)c1c[nH]c2ccccc12
InChIInChI=1S/C12H16N2O/c1-2-13-12(8-15)10-7-14-11-6-4-3-5-9(10)11/h3-7,12-15H,2,8H2,1H3
InChIKeyMUGRAAUVEGQNKK-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.81
Rot. Bonds4

About 2-(ethylamino)-2-(1H-indol-3-yl)ethanol

2-(ethylamino)-2-(1H-indol-3-yl)ethanol (PubChem CID 82282852) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-(ethylamino)-2-(1H-indol-3-yl)ethanol.

Molecular Properties

Compound Name2-(ethylamino)-2-(1H-indol-3-yl)ethanol
PubChem CID82282852
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-(ethylamino)-2-(1H-indol-3-yl)ethanol
SMILESCCNC(CO)c1c[nH]c2ccccc12
InChIInChI=1S/C12H16N2O/c1-2-13-12(8-15)10-7-14-11-6-4-3-5-9(10)11/h3-7,12-15H,2,8H2,1H3
InChIKeyMUGRAAUVEGQNKK-UHFFFAOYSA-N
XLogP1.81
TPSA48.05 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(1H-indol-3-yl)-N',N'-dimethylethane-1,2-diamine
CID 112743020
4-(1H-indol-3-yl)-2-methylhexan-1-ol
CID 174277465
(3R)-3-(1H-indol-3-yl)butan-1-ol
CID 93483686
N'-ethyl-1-(1H-indol-3-yl)ethane-1,2-diamine
CID 116934899
CID 176716315
CID 176716315
2-(1H-indol-3-yl)-2-(propylamino)acetonitrile
CID 84816526
3-propan-2-yl-1H-indole
CID 12534824
3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol
CID 141212916
1-(1H-indol-3-yl)-N'-propan-2-ylethane-1,2-diamine
CID 116935052
(2R,3S,4S)-5,5-bis(1H-indol-3-yl)pentane-1,2,3,4-tetrol
CID 73349379
5-(1H-indol-3-yl)heptan-1-ol
CID 141488119
(2S,3S)-3-(1H-indol-3-yl)butan-2-ol
CID 130705083

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-(1H-indol-3-yl)ethanol?
The IUPAC name of 2-(ethylamino)-2-(1H-indol-3-yl)ethanol (CID 82282852) is 2-(ethylamino)-2-(1H-indol-3-yl)ethanol.
What is the SMILES notation for 2-(ethylamino)-2-(1H-indol-3-yl)ethanol?
The canonical SMILES for 2-(ethylamino)-2-(1H-indol-3-yl)ethanol is CCNC(CO)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(ethylamino)-2-(1H-indol-3-yl)ethanol?
The InChIKey is MUGRAAUVEGQNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-2-13-12(8-15)10-7-14-11-6-4-3-5-9(10)11/h3-7,12-15H,2,8H2,1H3.
What are the key properties of 2-(ethylamino)-2-(1H-indol-3-yl)ethanol?
2-(ethylamino)-2-(1H-indol-3-yl)ethanol has a molecular weight of 204.27 g/mol, XLogP of 1.81, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-(1H-indol-3-yl)ethanol is sourced from PubChem (CID 82282852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).