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1-Cyano-2-((4-morpholinylacetyl)amino)-N-phenyl-5,6,7,8-tetrahydro-3-indolizinecarboxamide

HCID 393858
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Basic information

Standard SMILES
N#Cc1c(NC(=O)CN2CCOCC2)c(C(=O)Nc2ccccc2)n2c1CCCC2
InChIKey
AJLAEYYNXOQHMQ-UHFFFAOYSA-N
Molecular formula
C22H25N5O3
Average molar mass
407.5 g/mol
Monoisotopic mass
407.19573968

Names & identifiers

Preferred name
1-Cyano-2-((4-morpholinylacetyl)amino)-N-phenyl-5,6,7,8-tetrahydro-3-indolizinecarboxamide
IUPAC
1-cyano-2-[(2-morpholin-4-ylacetyl)amino]-N-phenyl-5,6,7,8-tetrahydroindolizine-3-carboxamide

Names & synonyms

NSC696785NSC-6967851-Cyano-2-((4-morpholinylacetyl)amino)-N-phenyl-5,6,7,8-tetrahydro-3-indolizinecarboxamide1-cyano-2-[(2-morpholinoacetyl)amino]-N-phenyl-5,6,7,8-tetrahydroindolizine-3-carboxamide

Database identifiers

PubChem CID
393858

Properties

Computed structural propertiesFilling in

XLogP
1.7
Topological polar surface area
99.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Formal charge
0
Complexity
665

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