4-Piperidinamine, 1-(2-(1H-indol-3-yl)ethyl)-, hydrate

HCID 215415

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 35633-77-3
Standard SMILES: NC1CCN(CCc2c[nH]c3ccccc23)CC1
InChIKey: OYRXLTLEMXGPPF-UHFFFAOYSA-N
Molecular formula: C15H21N3
Average molar mass: 243.35 g/mol
Monoisotopic mass: 243.17354767

Names & identifiers

Preferred name: 4-Piperidinamine, 1-(2-(1H-indol-3-yl)ethyl)-, hydrate
IUPAC: 1-[2-(1H-indol-3-yl)ethyl]piperidin-4-amine
English name: 4-AMino-1-(2-indol-3-ylethyl)piperidine
Molecular formula: C15H21N3
Molecular weight: 243.35

Names & synonyms

35633-77-33-(2-(4-Aminopiperid-1-yl)ethyl)indole hydrate4-Piperidinamine, 1-(2-(1H-indol-3-yl)ethyl)-, hydrate1-(2-(1H-Indol-3-yl)ethyl)-4-piperidinamine hydrateDTXSID80189145RefChem:295577DTXCID101116361-(2-(1H-Indol-3-yl)ethyl)piperidin-4-amine1-[2-(1h-indol-3-yl)ethyl]piperidin-4-amine4-amino-1-[2-(indol-3-yl)ethyl]piperidine4-Amino-1-(2-[indol-3-yl]ethyl)piperidine4-Amino-1-(2-indol-3-ylethyl)piperidine

Show more names

4-Piperidinamine, 1-[2-(1H-indol-3-yl)ethyl]-

SCHEMBL7954617OYRXLTLEMXGPPF-UHFFFAOYSA-N3-[2-(4-aminopiperidyl)ethyl]indoleAKOS022185728FD130713-[2-(4-aminopiperidyl) ethyl]indole3-[2-(4-aminopiperidyl)-ethyl]indole3-[2-(4-Amino-1-piperidyl)ethyl]indole

Database identifiers

CAS: 35633-77-3
PubChem CID: 215415
DTXSID: DTXSID80189145

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 45.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 260

Physicochemical properties

storage temp.: 2 · 2-8°C(protect from light)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319-H335
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501