Basic information
- Standard SMILES
O=C(NC/C=C\COc1cc(CN2CCCC2)ccn1)c1cn[nH]c1- InChIKey
IFPMSTFFTCSLAP-RJRFIUFISA-N- Molecular formula
- C18H23N5O2
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- N-{4-[4-(1-Pyrrolidinylmethyl)-2-pyridyloxy]-cis-2-butenyl}pyrazole-4-carboxamide
- IUPAC
- N-[(Z)-4-[[4-(pyrrolidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-enyl]-1H-pyrazole-4-carboxamide
Names & synonyms
SCHEMBL8920055IFPMSTFFTCSLAP-RJRFIUFISA-NN-{4-[4-(1-Pyrrolidinylmethyl)-2-pyridyloxy]-cis-2-butenyl}pyrazole-4-carboxamide
Database identifiers
- PubChem CID
- 67725971
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 439
Related reactions
1 records
Compound notes
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