(S)-2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-N-(piperidin-3-yl)pyrimidin-4-amine hydrochloride

HCID 67287751
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Basic information

Standard SMILES
Cl.Fc1cnc(-c2c[nH]c3ncc(Cl)cc23)nc1N[C@H]1CCCNC1
InChIKey
UNZUHBPZPQNJLX-PPHPATTJSA-N
Molecular formula
C16H17Cl2FN6
Average molar mass
383.2 g/mol

Names & identifiers

Preferred name
(S)-2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-N-(piperidin-3-yl)pyrimidin-4-amine hydrochloride
IUPAC
2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-N-[(3S)-piperidin-3-yl]pyrimidin-4-amine;hydrochloride

Names & synonyms

SCHEMBL2130497UNZUHBPZPQNJLX-PPHPATTJSA-N(S)-2-(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-fluoro-N-(piperidin-3-yl)pyrimidin-4-amine hydrochloride

Database identifiers

PubChem CID
67287751

Properties

Computed structural properties

Topological polar surface area
78.5 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
25

Related reactions

8 records
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Compound notes

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