Basic information
- CAS
74885-09-9- Standard SMILES
NCCc1c[nH]c2ccc(C(N)=O)cc12- InChIKey
WKZLNEWVIAGNAW-UHFFFAOYSA-N- Molecular formula
- C11H13N3O
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.10586205
Overview
5-carboxamidotryptamine is a member of tryptamines.
Names & identifiers
- Preferred name
- 5-Carboxamidotryptamine
- IUPAC
- 3-(2-aminoethyl)-1H-indole-5-carboxamide
- English name
- 3-(2-Amino-ethyl)-1H-indole-5-carboxylic acid amide
- Molecular formula
- C11H13N3O
- Molecular weight
- 203.24
Names & synonyms
5-Carboxamidotryptamine74885-09-93-(2-aminoethyl)-1H-indole-5-carboxamide5-Carboxyamidotryptamine5-Carboxamide tryptamine1H-Indole-5-carboxamide, 3-(2-aminoethyl)-91H76044O0CHEBI:48292RefChem:1022445-CTCHEMBL188403-(2-azanylethyl)-1H-indole-5-carboxamide
Show more names
5-CAT2-Carboxyamidotryptamine5-CARBOXAMINODOTRYPTAMINE5-Carboxamidotryptamine, 5-CT
5-carboxamidotryptamine hydrochloride[3H]-5-CT3-(2-Aminoethyl)-1H-indole-5-carboxamide Hydrochloride; 5-CT3-(2-Aminoethyl-1H-indole-5-carboxamideDTXSID60996379WKZLNEWVIAGNAW-UHFFFAOYSA-NUNII-91H76044O08K3
Database identifiers
- CAS
74885-09-9- PubChem CID
- 1809
- DTXSID
DTXSID60996379- ChEMBL
CHEMBL18840- ChEBI
CHEBI:48292
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- Boiling point
- 513.6 · 513.6±35.0 °C(Predicted)
- Density
- 1.293 · 1.293±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- solubility
- 2 O: · H2O: 10 mg/mL
- form
- solid
- pka
- 16.32 · 16.32±0.30(Predicted)
- color
- white or off-white
- Stability
- Hygroscopic
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 91 H76044O0 · 91H76044O0
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationEndogenous compounds and drugs that bind to and activate SEROTONIN RECEPTORS. Many serotonin receptor agonists are used as ANTIDEPRESSANTS; ANXIOLYTICS; and in the treatment of MIGRAINE DISORDERS.
Applications
Uses5-Carboxamidotryptamine maleate is an agonist of the 5-HT1 receptors.
Suppliers8 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海楼岚生物科技有限公司021-52996696，15000506266 15000506266
EMMX Biotechnology LLC888-539-0666 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Additional notes
DefinitionChEBI: 5-carboxamidotryptamine is a member of tryptamines.
Related reactions
1 records
Compound notes
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