Basic information
- CAS
101832-09-1- Standard SMILES
O=[N+]([O-])c1ccc2c(CN3CCCCC3)c[nH]c2c1- InChIKey
CGHIJADMYOVGCZ-UHFFFAOYSA-N- Molecular formula
- C14H17N3O2
- Average molar mass
- 259.3 g/mol
- Monoisotopic mass
- 259.13207679
Names & identifiers
- Preferred name
- Indole, 6-nitro-3-(piperidinomethyl)-
- IUPAC
- 6-nitro-3-(piperidin-1-ylmethyl)-1H-indole
Names & synonyms
101832-09-16-Nitro-3-(piperidinomethyl)indoleINDOLE, 6-NITRO-3-(PIPERIDINOMETHYL)-DTXSID20144238RefChem:349287DTXCID20667296-nitro-3-(piperidin-1-ylmethyl)-1H-indole6-nitro-3-[(piperidin-1-yl)methyl]-1H-indoleOprea1_036998MFCD011993806-nitro-3-(1-piperidylmethyl)-1H-indoleF471320
Database identifiers
- CAS
101832-09-1- PubChem CID
- 58970
- DTXSID
DTXSID20144238
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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