Indole, 3-(2-piperidylmethyl)-

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Basic information

CAS: 5275-05-8
Standard SMILES: c1ccc2c(CC3CCCCN3)c[nH]c2c1
InChIKey: NQAIQKCDQAOHIA-UHFFFAOYSA-N
Molecular formula: C14H18N2
Average molar mass: 214.31 g/mol
Monoisotopic mass: 214.14699858

Names & identifiers

Preferred name: Indole, 3-(2-piperidylmethyl)-
IUPAC: 3-(piperidin-2-ylmethyl)-1H-indole

Names & synonyms

3-(2-Piperidylmethyl)indole5275-05-8INDOLE, 3-(2-PIPERIDYLMETHYL)-RefChem:3492403-[(Piperidin-2-yl)methyl]-1H-indole3-(2-piperidinylmethyl)indoleSCHEMBL8790419DTXSID00967200NQAIQKCDQAOHIA-UHFFFAOYSA-N3-(piperid-2-ylmethyl)-1H-indoleEN300-1838226

Database identifiers

CAS: 5275-05-8
PubChem CID: 21346
DTXSID: DTXSID00967200
Nikkaji: J62.687B

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 27.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 229

Related reactions

5 records

New reaction record

HRID 744138As productuspto-grants-1996_09

HRID 744997As productuspto-grants-1996_09

HRID 975013As productuspto-grants-1997_03

HRID 1077851As productuspto-grants-1996_08

HRID 1901556As productuspto-grants-1996_11

Compound notes

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