2-(1-Cyclopropyl-5-trifluoromethyl-1H-pyrazol-4-yl)-N-[5-(7-isopropyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-pyridin-3-yl]-acetamide

HCID 70817366
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Basic information

Standard SMILES
CC(C)n1cc(C(=O)c2cncc(NC(=O)Cc3cnn(C4CC4)c3C(F)(F)F)c2)c2cncnc21
InChIKey
XPTNTAVJAXDPRS-UHFFFAOYSA-N
Molecular formula
C24H22F3N7O2
Average molar mass
497.5 g/mol

Names & identifiers

Preferred name
2-(1-Cyclopropyl-5-trifluoromethyl-1H-pyrazol-4-yl)-N-[5-(7-isopropyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-pyridin-3-yl]-acetamide
IUPAC
2-[1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-yl]-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide

Names & synonyms

2-(1-Cyclopropyl-5-trifluoromethyl-1H-pyrazol-4-yl)-N-[5-(7-isopropyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-pyridin-3-yl]-acetamideCHEMBL3666311SCHEMBL12984737BDBM134844US8846698, 315

Database identifiers

PubChem CID
70817366
ChEMBL
CHEMBL3666311

Properties

Computed structural properties

XLogP
2
Topological polar surface area
108 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
7
Heavy atoms
36

Related reactions

1 records
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Compound notes

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