2-chloro-N-(pyrrolidin-3-yl)pyrimidin-4-amine
Basic information
- CAS
945895-39-6- Standard SMILES
Clc1nccc(NC2CCNC2)n1- InChIKey
IUZWODQTCBZQSZ-UHFFFAOYSA-N- Molecular formula
- C8H11ClN4
- Average molar mass
- 198.65 g/mol
- Monoisotopic mass
- 198.0672241
Names & identifiers
- Preferred name
- 2-chloro-N-(pyrrolidin-3-yl)pyrimidin-4-amine
- IUPAC
- 2-chloro-N-pyrrolidin-3-ylpyrimidin-4-amine
Names & synonyms
2-chloro-N-(pyrrolidin-3-yl)pyrimidin-4-amine945895-39-6DTXSID401266194AKOS0063275542-Chloro-N-3-pyrrolidinyl-4-pyrimidinamineEN300-8085823
Database identifiers
- CAS
945895-39-6- PubChem CID
- 22309643
- DTXSID
DTXSID401266194
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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