Basic information
- CAS
26628-87-5- Standard SMILES
c1ccc2c(CCN3CCCCC3)c[nH]c2c1- InChIKey
PJVCNRSWJSLGCV-UHFFFAOYSA-N- Molecular formula
- C15H20N2
- Average molar mass
- 228.33 g/mol
- Monoisotopic mass
- 228.16264865
Names & identifiers
- Preferred name
- 3-(2-(1-Piperidinyl)ethyl)-1H-indole
- IUPAC
- 3-(2-piperidin-1-ylethyl)-1H-indole
- English name
- 3-[2-(1-Piperidinyl)ethyl]indole
- Molecular formula
- C15H20N2
- Molecular weight
- 228.33
Names & synonyms
26628-87-5INDOLE, 3-(2-PIPERIDINOETHYL)-DTXSID701811733-[2-(1-piperidinyl)ethyl]-1H-indole3-(2-(1-Piperidinyl)ethyl)-1H-indoleRefChem:1066457DTXCID801036643-(2-piperidin-1-ylethyl)-1H-indole3-(2-(piperidin-1-yl)ethyl)-1h-indole3-[2-(piperidin-1-yl)ethyl]-1H-indoleMLS0031713253-(2-Piperidinoethyl)indole
Show more names
3-(2-piperidinoethyl)-indol3-(2-Piperidinoethyl)-1H-indole3-[2-(1-Piperidinyl)ethyl]indole1H-Indole, 3-[2-(1-piperidinyl)ethyl]-
NSC 374698BRN 0178668NSC3746983-(2-piperidin-1-yl-ethyl)-1H-indoleSCHEMBL734226CHEMBL2138465SCHEMBL32669458AKOS015967426
Database identifiers
- CAS
26628-87-5- PubChem CID
- 33560
- DTXSID
DTXSID70181173- ChEMBL
CHEMBL2138465- Nikkaji
- J104.703E
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Melting point
- 150 · 150-151 °C(Solv: benzene (71-43-2))
- Boiling point
- 386.4 · 386.4±17.0 °C(Predicted)
- Density
- 1.096 · 1.096±0.06 g/cm3(Predicted)
- pka
- 17.3 · 17.30±0.30(Predicted)
Chemistry & industry
Suppliers9 total
APAC Pharmaceutical, LLC[email protected]
AlliChem, LLC[email protected]
CHEMPACIFIC[email protected]
TYGER[email protected]
上海洛茵氟化工有限公司[email protected]
上海维勒化工科技有限公司[email protected]
WATERSTONE[email protected]
先进技术工业有限公司[email protected]
FULCRUM—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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