3-(2-aminoethyl)-1H-indol-5-ol

C10H12N2O — CID 5202

IUPAC3-(2-aminoethyl)-1H-indol-5-ol
SMILESNCCc1c[nH]c2ccc(O)cc12
InChIInChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
InChIKeyQZAYGJVTTNCVMB-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.37
Rot. Bonds2

About 3-(2-aminoethyl)-1H-indol-5-ol

3-(2-aminoethyl)-1H-indol-5-ol (PubChem CID 5202) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 3-(2-aminoethyl)-1H-indol-5-ol.

Molecular Properties

Compound Name3-(2-aminoethyl)-1H-indol-5-ol
PubChem CID5202
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name3-(2-aminoethyl)-1H-indol-5-ol
SMILESNCCc1c[nH]c2ccc(O)cc12
InChIInChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
InChIKeyQZAYGJVTTNCVMB-UHFFFAOYSA-N
XLogP1.37
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

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Tegaserod
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CID 4980
Tryptophol
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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-1H-indol-5-ol?
The IUPAC name of 3-(2-aminoethyl)-1H-indol-5-ol (CID 5202) is 3-(2-aminoethyl)-1H-indol-5-ol.
What is the SMILES notation for 3-(2-aminoethyl)-1H-indol-5-ol?
The canonical SMILES for 3-(2-aminoethyl)-1H-indol-5-ol is NCCc1c[nH]c2ccc(O)cc12.
What is the InChIKey of 3-(2-aminoethyl)-1H-indol-5-ol?
The InChIKey is QZAYGJVTTNCVMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2.
What are the key properties of 3-(2-aminoethyl)-1H-indol-5-ol?
3-(2-aminoethyl)-1H-indol-5-ol has a molecular weight of 176.22 g/mol, XLogP of 1.37, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-1H-indol-5-ol is sourced from PubChem (CID 5202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).