(1-chloro-isoquinolin-3-yl)-(5-methyl-1H-pyrazol-3-yl)-amine

HCID 57799635
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Basic information

Standard SMILES
Cc1cc(Nc2cc3ccccc3c(Cl)n2)n[nH]1
InChIKey
XQWDMICEEIGJMY-UHFFFAOYSA-N
Molecular formula
C13H11ClN4
Average molar mass
258.7 g/mol

Names & identifiers

Preferred name
(1-chloro-isoquinolin-3-yl)-(5-methyl-1H-pyrazol-3-yl)-amine
IUPAC
1-chloro-N-(5-methyl-1H-pyrazol-3-yl)isoquinolin-3-amine

Names & synonyms

SCHEMBL3966868XQWDMICEEIGJMY-UHFFFAOYSA-N(1-chloro-isoquinolin-3-yl)-(5-methyl-1H-pyrazol-3-yl)-amine

Database identifiers

PubChem CID
57799635

Properties

Computed structural properties

XLogP
4
Topological polar surface area
53.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
18

Related reactions

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Compound notes

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(1-chloro-isoquinolin-3-yl)-(5-methyl-1H-pyrazol-3-yl)-amine (HCID 57799635)｜Huagongshe