chempirical

Methyltryptamine

C11H14N2CAS 61-49-4174.25 g/mol

Open in Covalent MOL file
HNNH
Secondary amine

Properties

Molecular formula
C11H14N2
Molar mass
174.25 g/mol
Exact mass
174.1157 Da
Melting point
90 °C
Boiling point
160–170 °C (at 0.01 Torr)
logP
1.93Crippen estimate
Polar surface area
27.8 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
61-49-4
SMILES
CNCCc1c[nH]c2ccccc12
InChIKey
NCIKQJBVUNUXLW-UHFFFAOYSA-N
InChI
InChI=1S/C11H14N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,12-13H,6-7H2,1H3

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Names and synonyms

14 names · show all
  • 1H-Indole-3-ethanamine, N-methyl-
  • Indole, 3-[2-(methylamino)ethyl]-
  • N-Methyl-1H-indole-3-ethanamine
  • Dipterine
  • N-Methyltryptamine
  • Nb-methyltryptamine
  • Monomethyltryptamine
  • N-Monomethyltryptamine
  • Nω-methyltryptamine
  • 3-(2-Methylaminoethyl)indole
  • 3-[2-(Methylamino)ethyl]-1H-indole
  • N10-Methyltryptamine
  • [2-(1H-Indol-3-yl)ethyl]methylamine
  • 2-(1H-Indol-3-yl)-N-methylethanamine

Work with Methyltryptamine

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

Similar compounds

3,3′-Diindolylmethane1968-05-458 % similar Indole-3-propanol3569-21-957 % similar 3-(2-Bromoethyl)indole3389-21-756 % similar Tryptophol526-55-656 % similar Tryptamine61-54-156 % similar Indole-3-carbinol700-06-153 % similar Tryptamine hydrochloride343-94-251 % similar N,N-Dipropyltryptamine61-52-951 % similar

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

Same formula

3-(Ethylphenylamino)propanenitrile148-87-8 5-Methyltryptamine1821-47-2 2-Methyltryptamine2731-06-8 (+-)-Alpha-Methyltryptamine299-26-3 Gramine87-52-5

Elsewhere

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