Basic information
- Standard SMILES
Clc1ccc2cnc(NC3CCNC3)nc2c1- InChIKey
UQJRABFQXGMOBY-UHFFFAOYSA-N- Molecular formula
- C12H13ClN4
- Average molar mass
- 248.71 g/mol
- Monoisotopic mass
- 248.0828741
Names & identifiers
- Preferred name
- (7-Chloro-quinazolin-2-yl)-pyrrolidin-3-yl-amine
- IUPAC
- 7-chloro-N-pyrrolidin-3-ylquinazolin-2-amine
Names & synonyms
SCHEMBL4248942UQJRABFQXGMOBY-UHFFFAOYSA-N(7-Chloro-quinazolin-2-yl)-pyrrolidin-3-yl-amine
Database identifiers
- PubChem CID
- 57748884
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 263
Related reactions
2 records
Compound notes
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