Basic information
- Standard SMILES
Cc1cc(NC(=O)NCCN2CCC(N)C2)c2ccccc2n1- InChIKey
YLJRSKZEOXKUOH-UHFFFAOYSA-N- Molecular formula
- C17H23N5O
- Average molar mass
- 313.4 g/mol
Names & identifiers
- Preferred name
- 1-[2-(3-Amino-pyrrolidin-1-yl)-ethyl]-3-(2-methyl-quinolin-4-yl)-urea
- IUPAC
- 1-[2-(3-aminopyrrolidin-1-yl)ethyl]-3-(2-methylquinolin-4-yl)urea
Names & synonyms
SCHEMBL4851818YLJRSKZEOXKUOH-UHFFFAOYSA-N1-[2-(3-Amino-pyrrolidin-1-yl)-ethyl]-3-(2-methyl-quinolin-4-yl)-urea
Database identifiers
- PubChem CID
- 59715917
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 83.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 404
Related reactions
3 records
Compound notes
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