7-Chloro-n-[2-(1h-imidazol-5-yl)ethyl]quinolin-4-amine
Basic information
- CAS
31510-33-5- Standard SMILES
Clc1ccc2c(NCCc3cnc[nH]3)ccnc2c1- InChIKey
CIBMOQNUWJHOOO-UHFFFAOYSA-N- Molecular formula
- C14H13ClN4
- Average molar mass
- 272.73 g/mol
- Monoisotopic mass
- 272.0828741
Names & identifiers
- Preferred name
- 7-Chloro-n-[2-(1h-imidazol-5-yl)ethyl]quinolin-4-amine
- IUPAC
- 7-chloro-N-[2-(1H-imidazol-5-yl)ethyl]quinolin-4-amine
Names & synonyms
31510-33-57-chloro-n-[2-(1h-imidazol-5-yl)ethyl]quinolin-4-amineNSC143512DTXSID80953500AKOS014566532NSC-143512
Database identifiers
- CAS
31510-33-5- PubChem CID
- 285872
- DTXSID
DTXSID80953500
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 53.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 289
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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