4-[6-Amino-5-(5-fluoro-2-methoxy-benzoyl)-pyridin-2-ylamino]-piperidine-1-carboxylic acid propyl ester

HCID 11711671
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Basic information

Standard SMILES
CCCOC(=O)N1CCC(Nc2ccc(C(=O)c3cc(F)ccc3OC)c(N)n2)CC1
InChIKey
PGIPQBRSBQOLLD-UHFFFAOYSA-N
Molecular formula
C22H27FN4O4
Average molar mass
430.5 g/mol
Monoisotopic mass
430.20163352

Names & identifiers

Preferred name
4-[6-Amino-5-(5-fluoro-2-methoxy-benzoyl)-pyridin-2-ylamino]-piperidine-1-carboxylic acid propyl ester
IUPAC
propyl 4-[[6-amino-5-(5-fluoro-2-methoxybenzoyl)-2-pyridinyl]amino]piperidine-1-carboxylate

Names & synonyms

SCHEMBL3835475PGIPQBRSBQOLLD-UHFFFAOYSA-N4-[6-Amino-5-(5-fluoro-2-methoxy-benzoyl)-pyridin-2-ylamino]-piperidine-1-carboxylic acid propyl ester

Database identifiers

PubChem CID
11711671

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
31

Related reactions

1 records
New reaction record

Linked notes

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