N-[2-(5-chloro-1H-indol-3-yl)ethyl]acetamide

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Basic information

Standard SMILES: CC(=O)NCCc1c[nH]c2ccc(Cl)cc12
InChIKey: WJIFPSFOSMKSAB-UHFFFAOYSA-N
Molecular formula: C12H13ClN2O
Average molar mass: 236.7 g/mol

Names & identifiers

Preferred name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]acetamide
IUPAC: N-[2-(5-chloro-1H-indol-3-yl)ethyl]acetamide

Names & synonyms

79087-58-4N-[2-(5-chloro-1H-indol-3-yl)ethyl]acetamideN-(2-(5-Chloro-1H-indol-3-yl)ethyl)acetamideNSC673655N-acetyl-5-chlorotryptamineCHEMBL288562SCHEMBL4510886WJIFPSFOSMKSAB-UHFFFAOYSA-NBDBM50471831STK630973AKOS003603581EBC-605165

Show more names

NSC-673655NCI60_026102DB-209919{N-[2-(5-Chloro-1H-indol-3-yl)ethyl]acetamide}N-[2-(5-Chloro-1H-indol-3-yl)-ethyl]-acetamide

Database identifiers

PubChem CID: 384240
ChEMBL: CHEMBL288562
Nikkaji: J1.016.971B

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 44.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 259

Related reactions

1 records

New reaction record

HRID 1432458As reactantuspto-grants-2009_11

Compound notes

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