5-((5-Chloro-4-((1-methylpiperidin-4-yl)amino)pyridin-2-yl)amino)pyrazine-2-carbonitrile
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Basic information
- Standard SMILES
CN1CCC(Nc2cc(Nc3cnc(C#N)cn3)ncc2Cl)CC1- InChIKey
ZQRCLEWJESQBLV-UHFFFAOYSA-N- Molecular formula
- C16H18ClN7
- Average molar mass
- 343.8 g/mol
- Monoisotopic mass
- 343.1312213
Names & identifiers
- Preferred name
- 5-((5-Chloro-4-((1-methylpiperidin-4-yl)amino)pyridin-2-yl)amino)pyrazine-2-carbonitrile
- IUPAC
- 5-[[5-chloro-4-[(1-methylpiperidin-4-yl)amino]-2-pyridinyl]amino]pyrazine-2-carbonitrile
Names & synonyms
1137477-49-65-((5-Chloro-4-((1-methylpiperidin-4-yl)amino)pyridin-2-yl)amino)pyrazine-2-carbonitrile5-({5-CHLORO-4-[(1-METHYLPIPERIDIN-4-YL)AMINO]PYRIDIN-2-YL}AMINO)PYRAZINE-2-CARBONITRILESCHEMBL617445ZQRCLEWJESQBLV-UHFFFAOYSA-N5-(5-Chloro-4-(1-methylpiperidin-4-ylamino)pyridin-2-ylamino)pyrazine-2-carbonitrile
Database identifiers
- PubChem CID
- 59613447
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 445
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Related reactions
2 records
Compound notes
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