6-Cyclopropylmethoxy-5-((S)-3-hydroxy-pyrrolidin-1-yl)-pyridine-2-carboxylic acid [1-methyl-1-(5-methyl-[1,2,4]oxadiazol-3-yl)-ethyl]-amide (HCID 71093530)

Substructure search Find similar structures

Basic information

Standard SMILES: Cc1nc(C(C)(C)NC(=O)c2ccc(N3CC[C@H](O)C3)c(OCC3CC3)n2)no1
InChIKey: QRQNOOONQLPXCG-AWEZNQCLSA-N
Molecular formula: C20H27N5O4
Average molar mass: 401.5 g/mol
Monoisotopic mass: 401.20630436

Names & identifiers

Preferred name: 6-Cyclopropylmethoxy-5-((S)-3-hydroxy-pyrrolidin-1-yl)-pyridine-2-carboxylic acid [1-methyl-1-(5-methyl-[1,2,4]oxadiazol-3-yl)-ethyl]-amide
IUPAC: 6-(cyclopropylmethoxy)-5-[(3S)-3-hydroxypyrrolidin-1-yl]-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]pyridine-2-carboxamide

Names & synonyms

SCHEMBL14167147QRQNOOONQLPXCG-AWEZNQCLSA-N6-Cyclopropylmethoxy-5-((S)-3-hydroxy-pyrrolidin-1-yl)-pyridine-2-carboxylic acid [1-methyl-1-(5-methyl-[1,2,4]oxadiazol-3-yl)-ethyl]-amide

Database identifiers

PubChem CID: 71093530

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 114 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 7
Heavy atoms: 29
Formal charge: 0
Complexity: 587

Related reactions

2 records

New reaction record

HRID 632405As productuspto-grants-2016_04

HRID 927791As productuspto-grants-2016_03

Compound notes

Loading…