5-Meo-nipt
Basic information
- CAS
109921-55-3- Standard SMILES
COc1ccc2[nH]cc(CCNC(C)C)c2c1- InChIKey
QQZJNZJNPDORBO-UHFFFAOYSA-N- Molecular formula
- C14H20N2O
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.15756327
Overview
a urinary metabolite of 5-methoxy-N,N-diisopropyltryptamine; structure in first source
Names & identifiers
- Preferred name
- 5-Meo-nipt
- IUPAC
- N-[2-(5-methoxy-1H-indol-3-yl)ethyl]propan-2-amine
- English name
- N-Isopropyl-5-methoxytryptamine
- Molecular formula
- C14H20N2O
- Molecular weight
- 232.32
Names & synonyms
109921-55-35-Methoxy-N-isopropyltryptamine5-MeO-NIPTCEP4J0P21UN-[2-(5-methoxy-1H-indol-3-yl)ethyl]propan-2-amine5-Methoxy-N-(1-methylethyl)-1H-indole-3-ethanamineN-(2-(5-methoxy-1H-indol-3-yl)ethyl)propan-2-amine1H-Indole-3-ethanamine, 5-methoxy-N-(1-methylethyl)-DTXSID00351701RefChem:103003DTXCID90302767N-Isopropyl-5-methoxytryptamine
Show more names
N-Isopropyl-5-methoxytryptamine USP/EP/BPN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2-propanamine
5-Methoxy-N-isopropyl Tryptamine5-methoxy NiPTUNII-CEP4J0P21U1H-Indole-3-ethanamine,5-methoxy-N-(1-methylethyl)-SCHEMBL14261141SCHEMBL30182982QQZJNZJNPDORBO-UHFFFAOYSA-NAKOS005595605
Database identifiers
- CAS
109921-55-3- PubChem CID
- 707167
- DTXSID
DTXSID00351701- UNII
- CEP4J0P21U
- Nikkaji
- J397.912A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 37.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- Boiling point
- 391.5 · 391.5±27.0 °C(Predicted)
- Density
- 1.068 · 1.068±0.06 g/cm3(Predicted)
- solubility
- 10 mg/ml · Acetonitrile: 10 mg/ml
- pka
- 16.95 · 16.95±0.30(Predicted)
- FDA UNII
- 4 J0P21U · CEP4J0P21U
Chemistry & industry
Pharmacology
Metabolism/Metabolites5-MeO-IPT is a known human metabolite of 5-Methoxy-N,N-diisopropyltryptamine.
Applications
UsesA metabolite of 5-Methoxy-N,N-diisopropyltryptamine (5-MeO-DIPT) (M262470) in human, a psychotomimetic tryptamine derivative.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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