3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol

C12H17N3O — CID 141212916

IUPAC3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol
SMILESCCNC(CN)c1c[nH]c2ccc(O)cc12
InChIInChI=1S/C12H17N3O/c1-2-14-12(6-13)10-7-15-11-4-3-8(16)5-9(10)11/h3-5,7,12,14-16H,2,6,13H2,1H3
InChIKeyBYTTVNWYDIVBJI-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.48
Rot. Bonds4

About 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol

3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol (PubChem CID 141212916) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol.

Molecular Properties

Compound Name3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol
PubChem CID141212916
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol
SMILESCCNC(CN)c1c[nH]c2ccc(O)cc12
InChIInChI=1S/C12H17N3O/c1-2-14-12(6-13)10-7-15-11-4-3-8(16)5-9(10)11/h3-5,7,12,14-16H,2,6,13H2,1H3
InChIKeyBYTTVNWYDIVBJI-UHFFFAOYSA-N
XLogP1.48
TPSA74.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2S)-1-aminopropan-2-yl]-1H-indol-5-ol
CID 23928157
3-(3-amino-1,1,1-trifluoropropan-2-yl)-1H-indol-5-ol
CID 84737251
2-(ethylamino)-2-(1H-indol-3-yl)ethanol
CID 82282852
3-[2-[4-[2,2-bis(5-hydroxy-1H-indol-3-yl)ethyl]phenyl]-1-(5-hydroxy-1H-indol-3-yl)ethyl]-1H-indol-5-ol
CID 155565501
2-[1-(5-hydroxy-1H-indol-3-yl)ethyl]-3-propyl-1H-indol-5-ol
CID 152819543
3-propyl-1H-indol-5-ol
CID 15366338
2-(5-hydroxy-1H-indol-3-yl)propanedioic acid
CID 91074600
2-amino-N-ethyl-3-(5-hydroxy-1H-indol-3-yl)propanamide
CID 19862462
2-(5-fluoro-1H-indol-3-yl)propan-1-amine
CID 13060
N-ethyl-1-(1H-indol-3-yl)-N',N'-dimethylethane-1,2-diamine
CID 112743020
3-(2-amino-1,2-ditritioethyl)-1H-indol-5-ol
CID 53317992
N-[2-hydroxy-2-(5-hydroxy-1H-indol-3-yl)ethyl]-2-methoxyacetamide
CID 123840111

Frequently Asked Questions

What is the IUPAC name of 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol?
The IUPAC name of 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol (CID 141212916) is 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol.
What is the SMILES notation for 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol?
The canonical SMILES for 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol is CCNC(CN)c1c[nH]c2ccc(O)cc12.
What is the InChIKey of 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol?
The InChIKey is BYTTVNWYDIVBJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-2-14-12(6-13)10-7-15-11-4-3-8(16)5-9(10)11/h3-5,7,12,14-16H,2,6,13H2,1H3.
What are the key properties of 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol?
3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol has a molecular weight of 219.29 g/mol, XLogP of 1.48, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-amino-1-(ethylamino)ethyl]-1H-indol-5-ol is sourced from PubChem (CID 141212916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).