chempirical

Serotonin

C10H12N2OCAS 50-67-9176.22 g/mol

Open in Covalent MOL file
H2NNHOH
PhenolPrimary amine

Properties

Molecular formula
C10H12N2O
Molar mass
176.22 g/mol
Exact mass
176.0950 Da
Melting point
167.5 °C
logP
1.37Crippen estimate
Polar surface area
62.0 Ų
H-bond donors / acceptors
3 / 2
Rotatable bonds
2

Hazards

Danger
Acute Toxic (GHS06)Health Hazard (GHS08)

Aggregated from 67 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P264, P270, P280, P301+P316, P318, P321, P330, P405, P501

Identifiers

CAS number
50-67-9
SMILES
NCCc1c[nH]c2ccc(O)cc12
InChIKey
QZAYGJVTTNCVMB-UHFFFAOYSA-N
InChI
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

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

18 names · show all
  • 1H-Indol-5-ol, 3-(2-aminoethyl)-
  • Indol-5-ol, 3-(2-aminoethyl)-
  • 3-(2-Aminoethyl)-1H-indol-5-ol
  • 5-HT
  • 3-(β-Aminoethyl)-5-hydroxyindole
  • 3-(2-Aminoethyl)indol-5-ol
  • DS substance
  • Enteramine
  • 5-HTA
  • 5-Hydroxy-3-(β-aminoethyl)indole
  • 5-Hydroxytryptamine
  • Substance DS
  • Thrombocytin
  • Thrombotonin
  • Tryptamine, 5-hydroxy-
  • Enteramin
  • 5-Hydroxyltryptamine
  • 5-Hydroxytriptamine

Work with Serotonin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Serotonin hydrochloride153-98-0Salt Serotonin adipate16031-83-7Salt

Similar compounds

5-Methyltryptamine1821-47-262 % similar 5-Chlorotryptamine3764-94-162 % similar 5-Fluorotryptamine576-16-962 % similar 5-Methoxytryptamine608-07-159 % similar 5-Methyltryptamine hydrochloride1010-95-357 % similar 5-Fluorotryptamine hydrochloride2711-58-257 % similar 5-Methyltryptamine hydrochloride55795-89-657 % similar 5-Chlorotryptamine hydrochloride942-26-757 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,2,3,4-Tetrahydroisoquinoline-3-carboxamide112794-29-3 1H-Benzimidazole-2-propanol2403-66-9 6-(Pyrrolidin-1-yl)pyridine-3-carbaldehyde261715-39-3 4-Methyl-1-phenylpyrazolidin-3-one2654-57-1 1-Acetyl-5-amino-2,3-dihydro-(1H)-indole4993-96-8 3-Phenylpiperazin-2-one5368-28-5 3-Dimethylamino-1-(3-pyridyl)-2-propen-1-one55314-16-4 4,5-Dihydro-4,4-dimethyl-2-(3-pyridyl)oxazole68981-86-2

Elsewhere

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