(2-Chloro-5-(2-thienyl)pyrimidine-4-yl)-(2-piperidin-1-yl-ethyl)-amine
Basic information
- Standard SMILES
Clc1ncc(-c2cccs2)c(NCCN2CCCCC2)n1- InChIKey
BBPYFBCMHWULRA-UHFFFAOYSA-N- Molecular formula
- C15H19ClN4S
- Average molar mass
- 322.9 g/mol
- Monoisotopic mass
- 322.1018955
Names & identifiers
- Preferred name
- (2-Chloro-5-(2-thienyl)pyrimidine-4-yl)-(2-piperidin-1-yl-ethyl)-amine
- IUPAC
- 2-chloro-N-(2-piperidin-1-ylethyl)-5-thiophen-2-ylpyrimidin-4-amine
Names & synonyms
SCHEMBL2819318BBPYFBCMHWULRA-UHFFFAOYSA-N(2-chloro-5-(2-thienyl)pyrimidine-4-yl)-(2-piperidin-1-yl-ethyl)-amine
Database identifiers
- PubChem CID
- 58985779
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 69.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 314
Related reactions
1 records
Compound notes
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